2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(cyclohexylcarbamoyl)propanamide

Systemtic Name: 2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(cyclohexylcarbamoyl)propanamide Openeye Name: 2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-N-(cyclohexylcarbamoyl)propanamide CAS Name: 2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-N-[(cyclohexylamino)-oxomethyl]propanamide IUPAC Name: 2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(cyclohexylcarbamoyl)propanamide Traditional Name: 2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-N-(cyclohexylcarbamoyl)propionamide Formula: C22H39N5O3 MolecularWeight: 421.57676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)N2CCN(CC2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC(C(=O)NC(=O)NC1CCCCC1)N2CCN(CC2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C22H39N5O3/c1-18(21(29)24-22(30)23-19-9-5-4-6-10-19)26-15-13-25(14-16-26)17-20(28)27-11-7-2-3-8-12-27/h18-19H,2-17H2,1H3,(H2,23,24,29,30)