4-(5-chloranylthiophen-2-yl)carbonyl-6-methoxy-1-[2-(1-propan-2-ylazepan-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-6-methoxy-1-[2-(1-propan-2-ylazepan-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-[2-(1-isopropylazepan-4-yl)ethyl]-6-methoxy-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-6-methoxy-1-[2-(1-propan-2-yl-4-azepanyl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-6-methoxy-1-[2-(1-propan-2-ylazepan-4-yl)ethyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-[2-(1-isopropylazepan-4-yl)ethyl]-6-methoxy-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C26H34ClN3O3S MolecularWeight: 504.08446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCCC(CC1)CCN2C(=O)CN(CC3=C2C=CC=C3OC)C(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC(C)N1CCCC(CC1)CCN2C(=O)CN(CC3=C2C=CC=C3OC)C(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C26H34ClN3O3S/c1-18(2)28-13-5-6-19(11-14-28)12-15-30-21-7-4-8-22(33-3)20(21)16-29(17-25(30)31)26(32)23-9-10-24(27)34-23/h4,7-10,18-19H,5-6,11-17H2,1-3H3