N-(2-azanylethyl)-2-(2,4-dichlorophenyl)-4-oxidanylidene-1-(2-thiophen-2-ylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-(2,4-dichlorophenyl)-4-oxidanylidene-1-(2-thiophen-2-ylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-2-(2,4-dichlorophenyl)-4-oxo-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-2-(2,4-dichlorophenyl)-4-oxo-1-(1-oxo-2-thiophen-2-ylethyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-2-(2,4-dichlorophenyl)-4-oxo-1-(2-thiophen-2-ylacetyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-2-(2,4-dichlorophenyl)-4-keto-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C24H22Cl2N4O3S MolecularWeight: 517.42748

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=C(C=C(C=C2)C(=O)NCCN)NC1=O)C(=O)CC3=CC=CS3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1C(N(C2=C(C=C(C=C2)C(=O)NCCN)NC1=O)C(=O)CC3=CC=CS3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H22Cl2N4O3S/c25-15-4-5-17(18(26)11-15)21-13-22(31)29-19-10-14(24(33)28-8-7-27)3-6-20(19)30(21)23(32)12-16-2-1-9-34-16/h1-6,9-11,21H,7-8,12-13,27H2,(H,28,33)(H,29,31)