N-(5-cyclohexyl-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-(4-piperidin-1-ylpiperidin-1-yl)benzamide

Systemtic Name: N-(5-cyclohexyl-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-(4-piperidin-1-ylpiperidin-1-yl)benzamide Openeye Name: N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(1-piperidyl)-1-piperidyl]benzamide CAS Name: N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(1-piperidinyl)-1-piperidinyl]benzamide IUPAC Name: N-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-(4-piperidin-1-ylpiperidin-1-yl)benzamide Traditional Name: N-(5-cyclohexyl-2-keto-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-(4-piperidinopiperidino)benzamide Formula: C35H47N5O2 MolecularWeight: 569.77998

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CC(=CC=C3)N4CCC(CC4)N5CCCCC5)C6CCCCC6

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CC(=CC=C3)N4CCC(CC4)N5CCCCC5)C6CCCCC6

InChI

InChI=1S/C35H47N5O2/c1-2-20-40-31-17-8-7-16-30(31)32(26-12-5-3-6-13-26)36-33(35(40)42)37-34(41)27-14-11-15-29(25-27)39-23-18-28(19-24-39)38-21-9-4-10-22-38/h7-8,11,14-17,25-26,28,33H,2-6,9-10,12-13,18-24H2,1H3,(H,37,41)