2-[3-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-(3-methylphenyl)-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-[2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-(3-methylphenyl)-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-[2-(2-ethoxyanilino)-2-oxo-ethyl]sulfanyl-5-(m-tolyl)-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-[[2-(2-ethoxyanilino)-2-oxoethyl]thio]-5-(3-methylphenyl)-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanyl-5-(3-methylphenyl)-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-[[2-keto-2-(o-phenetidino)ethyl]thio]-5-(m-tolyl)-1,2,4-triazol-4-yl]acetamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC(=O)N)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC(=O)N)C3=CC(=CC=C3)C

InChI

InChI=1S/C21H23N5O3S/c1-3-29-17-10-5-4-9-16(17)23-19(28)13-30-21-25-24-20(26(21)12-18(22)27)15-8-6-7-14(2)11-15/h4-11H,3,12-13H2,1-2H3,(H2,22,27)(H,23,28)