2-(4-tert-butylphenyl)sulfanyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(4-tert-butylphenyl)sulfanyl-acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-[(4-tert-butylphenyl)thio]acetamide Formula: C21H25N5OS3 MolecularWeight: 459.6511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=CC=C(C=C2)C(C)(C)C)C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=CC=C(C=C2)C(C)(C)C)C3=NNC(=S)N3CC=C

InChI

InChI=1S/C21H25N5OS3/c1-6-11-26-18(24-25-20(26)28)17-13(2)22-19(30-17)23-16(27)12-29-15-9-7-14(8-10-15)21(3,4)5/h6-10H,1,11-12H2,2-5H3,(H,25,28)(H,22,23,27)