(4-tert-butylphenyl)-[3-[(2-methoxyphenyl)amino]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[3-[(2-methoxyphenyl)amino]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone Openeye Name: (4-tert-butylphenyl)-[3-(2-methoxyanilino)-5-thioxo-1H-1,2,4-triazol-4-yl]methanone CAS Name: (4-tert-butylphenyl)-[3-(2-methoxyanilino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[3-(2-methoxyanilino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone Traditional Name: (4-tert-butylphenyl)-[3-(o-anisidino)-5-thioxo-1H-1,2,4-triazol-4-yl]methanone Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(=S)NN=C2NC3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(=S)NN=C2NC3=CC=CC=C3OC

InChI

InChI=1S/C20H22N4O2S/c1-20(2,3)14-11-9-13(10-12-14)17(25)24-18(22-23-19(24)27)21-15-7-5-6-8-16(15)26-4/h5-12H,1-4H3,(H,21,22)(H,23,27)