1-(3-methylphenyl)-3-[2-oxidanylidene-1-(2-oxidanylidene-2-pyridin-3-yl-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[2-oxidanylidene-1-(2-oxidanylidene-2-pyridin-3-yl-ethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-(m-tolyl)-3-[2-oxo-1-[2-oxo-2-(3-pyridyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-(3-methylphenyl)-3-[2-oxo-1-[2-oxo-2-(3-pyridinyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-(3-methylphenyl)-3-[2-oxo-1-(2-oxo-2-pyridin-3-ylethyl)-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-[2-keto-1-[2-keto-2-(3-pyridyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C30H25N5O3 MolecularWeight: 503.5512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5=CN=CC=C5

InChI

InChI=1S/C30H25N5O3/c1-20-9-7-13-23(17-20)32-30(38)34-28-29(37)35(19-26(36)22-12-8-16-31-18-22)25-15-6-5-14-24(25)27(33-28)21-10-3-2-4-11-21/h2-18,28H,19H2,1H3,(H2,32,34,38)