N-(3-chloranyl-4-methyl-phenyl)-4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazine-1-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-4-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]piperazine-1-carboxamide Formula: C21H31ClN4O2 MolecularWeight: 406.94944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(=O)NC3=CC(=C(C=C3)C)Cl)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(=O)NC3=CC(=C(C=C3)C)Cl)C

InChI

InChI=1S/C21H31ClN4O2/c1-15-10-16(2)13-26(12-15)20(27)14-24-6-8-25(9-7-24)21(28)23-18-5-4-17(3)19(22)11-18/h4-5,11,15-16H,6-10,12-14H2,1-3H3,(H,23,28)