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

Systemtic Name: cyclohexyl N-[1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylcarbonyl-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]carbamate Openeye Name: cyclohexyl N-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]carbamate CAS Name: N-[1-(1H-imidazol-5-ylmethyl)-4-[1-naphthalenyl(oxo)methyl]-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]carbamic acid cyclohexyl ester IUPAC Name: cyclohexyl N-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]carbamate Traditional Name: N-[1-(1H-imidazol-5-ylmethyl)-4-(1-naphthoyl)-3,5-dihydro-2H-1,4-benzodiazepin-8-yl]carbamic acid cyclohexyl ester Formula: C31H33N5O3 MolecularWeight: 523.62542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H33N5O3/c37-30(28-12-6-8-22-7-4-5-11-27(22)28)36-16-15-35(20-25-18-32-21-33-25)29-17-24(14-13-23(29)19-36)34-31(38)39-26-9-2-1-3-10-26/h4-8,11-14,17-18,21,26H,1-3,9-10,15-16,19-20H2,(H,32,33)(H,34,38)