N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-methylacetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-methyl-acetamide Formula: C17H21N5O2S2 MolecularWeight: 391.51094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H21N5O2S2/c1-3-4-9-22-16(24)19-20-17(22)25-11-15(23)21(2)10-14-18-12-7-5-6-8-13(12)26-14/h5-8H,3-4,9-11H2,1-2H3,(H,19,24)