N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(4-propan-2-ylphenyl)methyl]ethanamide

Systemtic Name: N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(4-propan-2-ylphenyl)methyl]ethanamide Openeye Name: N-[(4-isopropylphenyl)methyl]-N-methyl-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(4-propan-2-ylphenyl)methyl]acetamide IUPAC Name: N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(4-propan-2-ylphenyl)methyl]acetamide Traditional Name: N-(4-isopropylbenzyl)-N-methyl-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)N(C)CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=O)N(C)CC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H26N4OS/c1-15(2)18-10-8-17(9-11-18)13-25(4)20(27)14-26-21(23-24-22(26)28)19-7-5-6-16(3)12-19/h5-12,15H,13-14H2,1-4H3,(H,24,28)