3-(3,4-dichlorophenyl)-N-(1-methyl-2-oxidanylidene-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl)-2-phenyl-propanamide

Systemtic Name: 3-(3,4-dichlorophenyl)-N-(1-methyl-2-oxidanylidene-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl)-2-phenyl-propanamide Openeye Name: 3-(3,4-dichlorophenyl)-N-[1-methyl-2-oxo-5-(4-pyridyl)-3H-1,4-benzodiazepin-3-yl]-2-phenyl-propanamide CAS Name: 3-(3,4-dichlorophenyl)-N-(1-methyl-2-oxo-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl)-2-phenylpropanamide IUPAC Name: 3-(3,4-dichlorophenyl)-N-(1-methyl-2-oxo-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl)-2-phenylpropanamide Traditional Name: 3-(3,4-dichlorophenyl)-N-[2-keto-1-methyl-5-(4-pyridyl)-3H-1,4-benzodiazepin-3-yl]-2-phenyl-propionamide Formula: C30H24Cl2N4O2 MolecularWeight: 543.44316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(CC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C(CC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C30H24Cl2N4O2/c1-36-26-10-6-5-9-22(26)27(21-13-15-33-16-14-21)34-28(30(36)38)35-29(37)23(20-7-3-2-4-8-20)17-19-11-12-24(31)25(32)18-19/h2-16,18,23,28H,17H2,1H3,(H,35,37)