3-azanyl-1-cyclohexyl-5-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 3-azanyl-1-cyclohexyl-5-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 3-amino-1-cyclohexyl-5-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 3-amino-1-cyclohexyl-5-[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl]-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 3-amino-1-cyclohexyl-5-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 3-amino-1-cyclohexyl-5-[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CN2C3=CC=CC=C3N(CC(C2=O)N)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CN2C3=CC=CC=C3N(CC(C2=O)N)C4CCCCC4

InChI

InChI=1S/C23H29N3O2S/c1-15-12-18(16(2)29-15)22(27)14-26-21-11-7-6-10-20(21)25(13-19(24)23(26)28)17-8-4-3-5-9-17/h6-7,10-12,17,19H,3-5,8-9,13-14,24H2,1-2H3