N-[(E)-butan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[(E)-butan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-[(E)-1-methylpropylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-[(E)-butan-2-ylideneamino]-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-[(E)-butan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-[(E)-1-methylpropylideneamino]-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C)C

Isomeric SMILES

CC/C(=N/NC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C)/C

InChI

InChI=1S/C15H19N5OS/c1-4-11(2)17-18-14(21)13-7-5-12(6-8-13)9-22-15-19-16-10-20(15)3/h5-8,10H,4,9H2,1-3H3,(H,18,21)/b17-11+