1-(4-methylphenyl)-3-[[2-(4-methylphenyl)-1,3-dioxo-7,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindol-4-yl]methyl]thiourea (Q27200332)

SMR000206321 (English)

11 October 2016

chemical formula

C₂₄H₂₃N₃O₃S

1 reference

SMR000206321 (English)

11 October 2016

canonical SMILES

CC1=CC=C(C=C1)NC(=S)NCC23C=CC(O2)C4C3C(=O)N(C4=O)C5=CC=C(C=C5)C

1 reference

SMR000206321 (English)

InChI=1S/C24H23N3O3S/c1-14-3-7-16(8-4-14)26-23(31)25-13-24-12-11-18(30-24)19-20(24)22(29)27(21(19)28)17-9-5-15(2)6-10-17/h3-12,18-20H,13H2,1-2H3,(H2,25,26,31)

11 October 2016

Identifiers

InChI

1 reference

SMR000206321 (English)

UAKHLGWRPMSYGS-UHFFFAOYSA-N

11 October 2016

InChIKey

2 references

SMR000206321 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

1-(4-Methylphenyl)-3-{[4-(4-methylphenyl)-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-1-yl]methyl}thiourea (English)

11 October 2016

2 references

SMR000206321 (English)

matched by identifier from

11 October 2016

InChIKey

UAKHLGWRPMSYGS-UHFFFAOYSA-N

ChEBI ID

116606

mapping relation type

2 references

1-(4-methylphenyl)-3-[[2-(4-methylphenyl)-1,3-dioxo-7,7a-dihydro-3aH-octahydro-1H-4,7-epoxyisoindol-4-yl]methyl]thiourea (English)

matched by identifier from

11 October 2016

International Chemical Identifier

InChI

InChI=1S/C24H23N3O3S/c1-14-3-7-16(8-4-14)26-23(31)25-13-24-12-11-18(30-24)19-20(24)22(29)27(21(19)28)17-9-5-15(2)6-10-17/h3-12,18-20H,13H2,1-2H3,(H2,25,26,31)

1 reference