4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(2-pyridylmethyl)piperazine-1-carbonyl]propyl]benzamide CAS Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[4-(2-pyridinylmethyl)-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]butan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(2-pyridylmethyl)piperazine-1-carbonyl]propyl]benzamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)CC2=CC=CC=N2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN4O2/c1-16(2)20(25-21(28)17-6-8-18(23)9-7-17)22(29)27-13-11-26(12-14-27)15-19-5-3-4-10-24-19/h3-10,16,20H,11-15H2,1-2H3,(H,25,28)/t20-/m0/s1