1-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide

Systemtic Name: 1-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide Openeye Name: 1-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetyl]indoline-5-sulfonamide CAS Name: 1-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-1-oxoethyl]-2,3-dihydroindole-5-sulfonamide IUPAC Name: 1-[2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetyl]-2,3-dihydroindole-5-sulfonamide Traditional Name: 1-[2-[4-(4-cyanobenzyl)-1,4-diazepan-1-yl]acetyl]indoline-5-sulfonamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN(C1)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H27N5O3S/c24-15-18-2-4-19(5-3-18)16-26-9-1-10-27(13-12-26)17-23(29)28-11-8-20-14-21(32(25,30)31)6-7-22(20)28/h2-7,14H,1,8-13,16-17H2,(H2,25,30,31)