(2S)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-2-[4-(2-pyridyl)piperazin-1-yl]propanamide CAS Name: (2S)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-[4-(2-pyridinyl)-1-piperazinyl]propanamide IUPAC Name: (2S)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide Traditional Name: (2S)-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-2-[4-(2-pyridyl)piperazino]propionamide Formula: C22H29N5O2 MolecularWeight: 395.49796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C(C)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)[C@H](C)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C22H29N5O2/c1-17-7-9-19(10-8-17)24-21(28)16-25(3)22(29)18(2)26-12-14-27(15-13-26)20-6-4-5-11-23-20/h4-11,18H,12-16H2,1-3H3,(H,24,28)/t18-/m0/s1