1-[4-methoxy-3-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone Formula: C19H18N2O2S3 MolecularWeight: 402.55342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C19H18N2O2S3/c1-12-6-4-5-7-16(12)21-19(24)26-18(20-21)25-11-15-10-14(13(2)22)8-9-17(15)23-3/h4-10H,11H2,1-3H3