1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylcarbonyl-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea

Systemtic Name: 1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylcarbonyl-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea Openeye Name: 1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea CAS Name: 1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-[1-naphthalenyl(oxo)methyl]-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea IUPAC Name: 1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea Traditional Name: 1-cyclohexyl-3-[1-(1H-imidazol-5-ylmethyl)-4-(1-naphthoyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]urea Formula: C31H34N6O2 MolecularWeight: 522.64066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=CC3=C(CN(CCN3CC4=CN=CN4)C(=O)C5=CC=CC6=CC=CC=C65)C=C2

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=CC3=C(CN(CCN3CC4=CN=CN4)C(=O)C5=CC=CC6=CC=CC=C65)C=C2

InChI

InChI=1S/C31H34N6O2/c38-30(28-12-6-8-22-7-4-5-11-27(22)28)37-16-15-36(20-26-18-32-21-33-26)29-17-25(14-13-23(29)19-37)35-31(39)34-24-9-2-1-3-10-24/h4-8,11-14,17-18,21,24H,1-3,9-10,15-16,19-20H2,(H,32,33)(H2,34,35,39)