(2S)-N-(2-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-(2-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(o-tolyl)propanamide CAS Name: (2S)-N-(2-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-(2-methylphenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(o-tolyl)propionamide Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=CN2CC=C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C)SC2=NN=CN2CC=C

InChI

InChI=1S/C15H18N4OS/c1-4-9-19-10-16-18-15(19)21-12(3)14(20)17-13-8-6-5-7-11(13)2/h4-8,10,12H,1,9H2,2-3H3,(H,17,20)/t12-/m0/s1