3-[[[1-[1-(2-furanylmethyl)-5-tetrazolyl]-2-methylpropyl]-(2-oxolanylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one (Q27190846)

MLS000031960 (English)

10 October 2016

chemical formula

C₂₆H₃₂N₆O₃

1 reference

MLS000031960 (English)

10 October 2016

canonical SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3CCCO3)C(C4=NN=NN4CC5=CC=CO5)C(C)C

1 reference

MLS000031960 (English)

InChI=1S/C26H32N6O3/c1-17(2)24(25-28-29-30-32(25)16-22-10-6-12-35-22)31(15-21-9-5-11-34-21)14-20-13-19-8-4-7-18(3)23(19)27-26(20)33/h4,6-8,10,12-13,17,21,24H,5,9,11,14-16H2,1-3H3,(H,27,33)

10 October 2016

Identifiers

InChI

1 reference

MLS000031960 (English)

LRBIOTSODMGLHL-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

MLS000031960 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

3-{[{1-[1-(2-Furylmethyl)-1H-tetrazol-5-yl]-2-methylpropyl}(tetrahydro-2-furanylmethyl)amino]methyl}-8-methyl-2(1H)-quinolinone (English)

10 October 2016

2 references

MLS000031960 (English)

matched by identifier from

10 October 2016

InChIKey

LRBIOTSODMGLHL-UHFFFAOYSA-N

ChEBI ID

111231

mapping relation type

2 references

3-[[[1-[1-(2-furanylmethyl)-5-tetrazolyl]-2-methylpropyl]-(2-oxolanylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one (English)

matched by identifier from

10 October 2016

International Chemical Identifier

InChI

InChI=1S/C26H32N6O3/c1-17(2)24(25-28-29-30-32(25)16-22-10-6-12-35-22)31(15-21-9-5-11-34-21)14-20-13-19-8-4-7-18(3)23(19)27-26(20)33/h4,6-8,10,12-13,17,21,24H,5,9,11,14-16H2,1-3H3,(H,27,33)

1 reference