1-[5-[cyclohexyl(methyl)amino]-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[5-[cyclohexyl(methyl)amino]-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[5-[cyclohexyl(methyl)amino]-2-keto-1-propyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C)N(C)C4CCCCC4

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C)N(C)C4CCCCC4

InChI

InChI=1S/C27H35N5O2/c1-4-17-32-23-16-9-8-15-22(23)25(31(3)21-13-6-5-7-14-21)29-24(26(32)33)30-27(34)28-20-12-10-11-19(2)18-20/h8-12,15-16,18,21,24H,4-7,13-14,17H2,1-3H3,(H2,28,30,34)