1-(1,3-benzothiazol-2-yl)-4-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-one

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-4-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-4-(p-tolyl)-5-thioxo-1,2,4-triazolidin-3-one CAS Name: 1-(1,3-benzothiazol-2-yl)-4-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-4-(4-methylphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-(p-tolyl)-5-thioxo-1,2,4-triazolidin-3-one Formula: C16H12N4OS2 MolecularWeight: 340.42268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)NN(C2=S)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)NN(C2=S)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H12N4OS2/c1-10-6-8-11(9-7-10)19-14(21)18-20(16(19)22)15-17-12-4-2-3-5-13(12)23-15/h2-9H,1H3,(H,18,21)