N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]acetamide Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)CC(=O)NC(C)(C#N)C3CC3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)CC(=O)N[C@](C)(C#N)C3CC3)OC)OC

InChI

InChI=1S/C22H32N4O3/c1-16-11-19(28-3)20(29-4)12-17(16)13-25-7-9-26(10-8-25)14-21(27)24-22(2,15-23)18-5-6-18/h11-12,18H,5-10,13-14H2,1-4H3,(H,24,27)/t22-/m1/s1