4-(5-chloranylthiophen-2-yl)carbonyl-1-[2-(1-ethylazepan-4-yl)ethyl]-6-oxidanyl-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-[2-(1-ethylazepan-4-yl)ethyl]-6-oxidanyl-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-[2-(1-ethylazepan-4-yl)ethyl]-6-hydroxy-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[2-(1-ethyl-4-azepanyl)ethyl]-6-hydroxy-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-[2-(1-ethylazepan-4-yl)ethyl]-6-hydroxy-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-[2-(1-ethylazepan-4-yl)ethyl]-6-hydroxy-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C24H30ClN3O3S MolecularWeight: 476.0313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(CC1)CCN2C(=O)CN(CC3=C2C=CC=C3O)C(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CCN1CCCC(CC1)CCN2C(=O)CN(CC3=C2C=CC=C3O)C(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C24H30ClN3O3S/c1-2-26-12-4-5-17(10-13-26)11-14-28-19-6-3-7-20(29)18(19)15-27(16-23(28)30)24(31)21-8-9-22(25)32-21/h3,6-9,17,29H,2,4-5,10-16H2,1H3