N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide (Q27185935)

SMR000074721 (English)

10 October 2016

chemical formula

C₂₂H₂₁N₃O₅S₂

1 reference

SMR000074721 (English)

10 October 2016

canonical SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC(=O)C4COC5=CC=CC=C5O4

1 reference

SMR000074721 (English)

InChI=1S/C22H21N3O5S2/c26-21(20-13-29-18-5-1-2-6-19(18)30-20)24-22-23-17(14-31-22)15-7-9-16(10-8-15)32(27,28)25-11-3-4-12-25/h1-2,5-10,14,20H,3-4,11-13H2,(H,23,24,26)

10 October 2016

Identifiers

InChI

1 reference

SMR000074721 (English)

UQGXWGVQAVBUGD-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

SMR000074721 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

N-{4-[4-(1-Pyrrolidinylsulfonyl)phenyl]-1,3-thiazol-2-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide (English)

10 October 2016

2 references

SMR000074721 (English)

matched by identifier from

10 October 2016

InChIKey

UQGXWGVQAVBUGD-UHFFFAOYSA-N

ChEBI ID

107610

mapping relation type

2 references

N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide (English)

matched by identifier from

10 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H21N3O5S2/c26-21(20-13-29-18-5-1-2-6-19(18)30-20)24-22-23-17(14-31-22)15-7-9-16(10-8-15)32(27,28)25-11-3-4-12-25/h1-2,5-10,14,20H,3-4,11-13H2,(H,23,24,26)

1 reference