1-(5-cyclohexyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]urea

Systemtic Name: 1-(5-cyclohexyl-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]urea Openeye Name: 1-(5-cyclohexyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-[4-(1-piperidyl)-1-piperidyl]phenyl]urea CAS Name: 1-(5-cyclohexyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-[4-(1-piperidinyl)-1-piperidinyl]phenyl]urea IUPAC Name: 1-(5-cyclohexyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]urea Traditional Name: 1-(5-cyclohexyl-2-keto-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-[4-(4-piperidinopiperidino)phenyl]urea Formula: C32H42N6O2 MolecularWeight: 542.71488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C3C=CC=CC3=NC(=O)C(N2)NC(=O)NC4=CC=C(C=C4)N5CCC(CC5)N6CCCCC6

Isomeric SMILES

C1CCC(CC1)C2=C3C=CC=CC3=NC(=O)C(N2)NC(=O)NC4=CC=C(C=C4)N5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C32H42N6O2/c39-31-30(35-29(23-9-3-1-4-10-23)27-11-5-6-12-28(27)34-31)36-32(40)33-24-13-15-25(16-14-24)38-21-17-26(18-22-38)37-19-7-2-8-20-37/h5-6,11-16,23,26,30,35H,1-4,7-10,17-22H2,(H2,33,36,40)