N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H15N5OS3 MolecularWeight: 401.5289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C17H15N5OS3/c1-10-4-5-11-13(9-10)26-16(18-11)19-14(23)6-7-22-15(20-21-17(22)24)12-3-2-8-25-12/h2-5,8-9H,6-7H2,1H3,(H,21,24)(H,18,19,23)