3-[4-methyl-5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide

Systemtic Name: 3-[4-methyl-5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide Openeye Name: 3-[4-methyl-5-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(p-tolyl)propanamide CAS Name: 3-[4-methyl-5-[[2-(3-methylanilino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide IUPAC Name: 3-[4-methyl-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide Traditional Name: 3-[5-[[2-keto-2-(m-toluidino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]-N-(p-tolyl)propionamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC2=NN=C(N2C)SCC(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC2=NN=C(N2C)SCC(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C22H25N5O2S/c1-15-7-9-17(10-8-15)23-20(28)12-11-19-25-26-22(27(19)3)30-14-21(29)24-18-6-4-5-16(2)13-18/h4-10,13H,11-12,14H2,1-3H3,(H,23,28)(H,24,29)