4-(5-methylpyrazol-1-yl)-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide

Systemtic Name: 4-(5-methylpyrazol-1-yl)-N-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]benzamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]-4-(5-methylpyrazol-1-yl)benzamide CAS Name: 4-(5-methyl-1-pyrazolyl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide IUPAC Name: 4-(5-methylpyrazol-1-yl)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]-4-(5-methylpyrazol-1-yl)benzamide Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=CC=C(C=C1)N2C(=CC=N2)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)N2C(=CC=N2)C

InChI

InChI=1S/C17H22N4O2/c1-4-10-18-16(22)13(3)20-17(23)14-5-7-15(8-6-14)21-12(2)9-11-19-21/h5-9,11,13H,4,10H2,1-3H3,(H,18,22)(H,20,23)/t13-/m0/s1