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

Systemtic Name: 3-[4-methyl-5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[[2-(3-methylanilino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-keto-2-(m-toluidino)ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C)CCC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C)CCC(=O)N

InChI

InChI=1S/C15H19N5O2S/c1-10-4-3-5-11(8-10)17-14(22)9-23-15-19-18-13(20(15)2)7-6-12(16)21/h3-5,8H,6-7,9H2,1-2H3,(H2,16,21)(H,17,22)