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

Systemtic Name: 1-[1-(2-cyclopentyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3-(dimethylamino)phenyl]urea Openeye Name: 1-[1-(2-cyclopentyl-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3-(dimethylamino)phenyl]urea CAS Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3-(dimethylamino)phenyl]urea IUPAC Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3-(dimethylamino)phenyl]urea Traditional Name: 1-[1-(2-cyclopentyl-2-keto-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-[3-(dimethylamino)phenyl]urea Formula: C31H33N5O3 MolecularWeight: 523.62542

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5CCCC5

Isomeric SMILES

CN(C)C1=CC=CC(=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5CCCC5

InChI

InChI=1S/C31H33N5O3/c1-35(2)24-16-10-15-23(19-24)32-31(39)34-29-30(38)36(20-27(37)21-11-6-7-12-21)26-18-9-8-17-25(26)28(33-29)22-13-4-3-5-14-22/h3-5,8-10,13-19,21,29H,6-7,11-12,20H2,1-2H3,(H2,32,34,39)