N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylthio)butanamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(1H-1,2,4-triazol-5-ylthio)butyramide Formula: C14H15N5O2S2 MolecularWeight: 349.4312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC=NN3

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=NC=NN3

InChI

InChI=1S/C14H15N5O2S2/c1-3-10(22-13-15-7-16-19-13)12(20)18-14-17-9-5-4-8(21-2)6-11(9)23-14/h4-7,10H,3H2,1-2H3,(H,15,16,19)(H,17,18,20)