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

Systemtic Name: 1-[1-(2-cyclopentyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[1-(2-cyclopentyl-2-oxo-ethyl)-2-oxo-5-(4-pyridyl)-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-pyridin-4-yl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[1-(2-cyclopentyl-2-keto-ethyl)-2-keto-5-(4-pyridyl)-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C29H29N5O3 MolecularWeight: 495.57226

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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=NC=C4)CC(=O)C5CCCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=NC=C4)CC(=O)C5CCCC5

InChI

InChI=1S/C29H29N5O3/c1-19-7-6-10-22(17-19)31-29(37)33-27-28(36)34(18-25(35)20-8-2-3-9-20)24-12-5-4-11-23(24)26(32-27)21-13-15-30-16-14-21/h4-7,10-17,20,27H,2-3,8-9,18H2,1H3,(H2,31,33,37)