N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(5-acetyl-4-methyl-2-thiazolyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(5-acetyl-4-methyl-thiazol-2-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C16H15N5O2S2 MolecularWeight: 373.4526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3)C(=O)C

InChI

InChI=1S/C16H15N5O2S2/c1-9-13(10(2)22)25-16(19-9)20-14(23)12-5-3-11(4-6-12)7-24-15-17-8-18-21-15/h3-6,8H,7H2,1-2H3,(H,17,18,21)(H,19,20,23)