(4-methylphenyl) (NZ)-N-[2-tert-butyl-3-(4-methylphenyl)sulfanyl-1,2,4-thiadiazol-5-ylidene]carbamodithioate

Systemtic Name: (4-methylphenyl) (NZ)-N-[2-tert-butyl-3-(4-methylphenyl)sulfanyl-1,2,4-thiadiazol-5-ylidene]carbamodithioate Openeye Name: p-tolyl (NZ)-N-[2-tert-butyl-3-(p-tolylsulfanyl)-1,2,4-thiadiazol-5-ylidene]carbamodithioate CAS Name: (NZ)-N-[2-tert-butyl-3-[(4-methylphenyl)thio]-1,2,4-thiadiazol-5-ylidene]carbamodithioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) (NZ)-N-[2-tert-butyl-3-(4-methylphenyl)sulfanyl-1,2,4-thiadiazol-5-ylidene]carbamodithioate Traditional Name: (NZ)-N-[2-tert-butyl-3-(p-tolylthio)-1,2,4-thiadiazol-5-ylidene]carbamodithioic acid p-tolyl ester Formula: C21H23N3S4 MolecularWeight: 445.68742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC(=NC(=S)SC3=CC=C(C=C3)C)SN2C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=N/C(=N/C(=S)SC3=CC=C(C=C3)C)/SN2C(C)(C)C

InChI

InChI=1S/C21H23N3S4/c1-14-6-10-16(11-7-14)26-19-22-18(28-24(19)21(3,4)5)23-20(25)27-17-12-8-15(2)9-13-17/h6-13H,1-5H3/b23-18-