N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H15N5OS3 MolecularWeight: 401.5289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=NNC(=N3)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=NNC(=N3)C4=CC=CS4)C

InChI

InChI=1S/C17H15N5OS3/c1-9-6-10(2)14-12(7-9)26-16(19-14)18-13(23)8-25-17-20-15(21-22-17)11-4-3-5-24-11/h3-7H,8H2,1-2H3,(H,18,19,23)(H,20,21,22)