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

Systemtic Name: 1-(3-cyanophenyl)-3-[1-(2-cyclopentyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-(3-cyanophenyl)-3-[1-(2-cyclopentyl-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-(3-cyanophenyl)-3-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-(3-cyanophenyl)-3-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-(3-cyanophenyl)-3-[1-(2-cyclopentyl-2-keto-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Formula: C30H27N5O3 MolecularWeight: 505.56708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC(=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC(=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C30H27N5O3/c31-18-20-9-8-14-23(17-20)32-30(38)34-28-29(37)35(19-26(36)21-10-4-5-11-21)25-16-7-6-15-24(25)27(33-28)22-12-2-1-3-13-22/h1-3,6-9,12-17,21,28H,4-5,10-11,19H2,(H2,32,34,38)