N-cyclohexyl-4-[4-(2-methylpropanoylamino)-2-piperidin-1-ylcarbonyl-phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[4-(2-methylpropanoylamino)-2-piperidin-1-ylcarbonyl-phenyl]-1,4-diazepane-1-carboxamide Openeye Name: N-cyclohexyl-4-[4-(2-methylpropanoylamino)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide CAS Name: N-cyclohexyl-4-[4-[(2-methyl-1-oxopropyl)amino]-2-[oxo(1-piperidinyl)methyl]phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-cyclohexyl-4-[4-(2-methylpropanoylamino)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: N-cyclohexyl-4-[4-(isobutyrylamino)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide Formula: C28H43N5O3 MolecularWeight: 497.67272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCCN(CC2)C(=O)NC3CCCCC3)C(=O)N4CCCCC4

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCCN(CC2)C(=O)NC3CCCCC3)C(=O)N4CCCCC4

InChI

InChI=1S/C28H43N5O3/c1-21(2)26(34)29-23-12-13-25(24(20-23)27(35)32-14-7-4-8-15-32)31-16-9-17-33(19-18-31)28(36)30-22-10-5-3-6-11-22/h12-13,20-22H,3-11,14-19H2,1-2H3,(H,29,34)(H,30,36)