N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H13N5OS2 MolecularWeight: 319.40522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H13N5OS2/c1-8-16-17-13(18(8)2)20-7-11(19)15-12-14-9-5-3-4-6-10(9)21-12/h3-6H,7H2,1-2H3,(H,14,15,19)