4-[3-[3-(3,4-dichlorophenyl)propanoylamino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl]benzamide

Systemtic Name: 4-[3-[3-(3,4-dichlorophenyl)propanoylamino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl]benzamide Openeye Name: 4-[3-[3-(3,4-dichlorophenyl)propanoylamino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl]benzamide CAS Name: 4-[3-[[3-(3,4-dichlorophenyl)-1-oxopropyl]amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl]benzamide IUPAC Name: 4-[3-[3-(3,4-dichlorophenyl)propanoylamino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl]benzamide Traditional Name: 4-[3-[3-(3,4-dichlorophenyl)propanoylamino]-2-keto-1-methyl-3H-1,4-benzodiazepin-5-yl]benzamide Formula: C26H22Cl2N4O3 MolecularWeight: 509.38388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3=CC(=C(C=C3)Cl)Cl)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3=CC(=C(C=C3)Cl)Cl)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C26H22Cl2N4O3/c1-32-21-5-3-2-4-18(21)23(16-8-10-17(11-9-16)24(29)34)31-25(26(32)35)30-22(33)13-7-15-6-12-19(27)20(28)14-15/h2-6,8-12,14,25H,7,13H2,1H3,(H2,29,34)(H,30,33)