3-(2-methylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-(2-methylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-[(2-nitrophenyl)methylsulfanyl]-3-(o-tolyl)-1,3,4-thiadiazole-2-thione CAS Name: 3-(2-methylphenyl)-5-[(2-nitrophenyl)methylthio]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-(2-methylphenyl)-5-[(2-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-[(2-nitrobenzyl)thio]-3-(o-tolyl)-1,3,4-thiadiazole-2-thione Formula: C16H13N3O2S3 MolecularWeight: 375.48832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2S3/c1-11-6-2-4-8-13(11)18-16(22)24-15(17-18)23-10-12-7-3-5-9-14(12)19(20)21/h2-9H,10H2,1H3