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

Systemtic Name: N-(heptan-4-ylideneamino)-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(1-propylbutylideneamino)benzamide CAS Name: N-(heptan-4-ylideneamino)-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(heptan-4-ylideneamino)-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-N-(1-propylbutylideneamino)benzamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5OS/c1-4-6-16(7-5-2)20-21-17(24)15-10-8-14(9-11-15)12-25-18-22-19-13-23(18)3/h8-11,13H,4-7,12H2,1-3H3,(H,21,24)