5-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(2-methylphenyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(2-methylphenyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(o-tolyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(1,3-benzothiazol-2-ylmethylthio)-3-(2-methylphenyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(2-methylphenyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(1,3-benzothiazol-2-ylmethylthio)-3-(o-tolyl)-1,3,4-thiadiazole-2-thione Formula: C17H13N3S4 MolecularWeight: 387.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3S4/c1-11-6-2-4-8-13(11)20-17(21)24-16(19-20)22-10-15-18-12-7-3-5-9-14(12)23-15/h2-9H,10H2,1H3