N,N-dimethyl-2-[3-[[3-(methylamino)phenyl]carbamoylamino]-2-oxidanylidene-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[3-[[3-(methylamino)phenyl]carbamoylamino]-2-oxidanylidene-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[3-[[3-(methylamino)phenyl]carbamoylamino]-2-oxo-5-(2-pyridyl)-3H-1,4-benzodiazepin-1-yl]acetamide CAS Name: N,N-dimethyl-2-[3-[[[3-(methylamino)anilino]-oxomethyl]amino]-2-oxo-5-(2-pyridinyl)-3H-1,4-benzodiazepin-1-yl]acetamide IUPAC Name: N,N-dimethyl-2-[3-[[3-(methylamino)phenyl]carbamoylamino]-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]acetamide Traditional Name: 2-[2-keto-3-[[3-(methylamino)phenyl]carbamoylamino]-5-(2-pyridyl)-3H-1,4-benzodiazepin-1-yl]-N,N-dimethyl-acetamide Formula: C26H27N7O3 MolecularWeight: 485.53768

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC(=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=N4)CC(=O)N(C)C

Isomeric SMILES

CNC1=CC=CC(=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=N4)CC(=O)N(C)C

InChI

InChI=1S/C26H27N7O3/c1-27-17-9-8-10-18(15-17)29-26(36)31-24-25(35)33(16-22(34)32(2)3)21-13-5-4-11-19(21)23(30-24)20-12-6-7-14-28-20/h4-15,24,27H,16H2,1-3H3,(H2,29,31,36)