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

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(pentan-3-ylideneamino)benzamide Openeye Name: N-(1-ethylpropylideneamino)-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-N-(pentan-3-ylideneamino)benzamide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(pentan-3-ylideneamino)benzamide Traditional Name: N-(1-ethylpropylideneamino)-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5OS/c1-4-14(5-2)18-19-15(22)13-8-6-12(7-9-13)10-23-16-20-17-11-21(16)3/h6-9,11H,4-5,10H2,1-3H3,(H,19,22)