2-[3-cyclopropyl-5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-cyclopropyl-5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-cyclopropyl-5-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-cyclopropyl-5-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-cyclopropyl-5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-cyclopropyl-5-[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]-1,2,4-triazol-4-yl]acetamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC(=O)N)C3CC3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC(=O)N)C3CC3)C

InChI

InChI=1S/C18H23N5O2S/c1-3-12-6-4-5-11(2)16(12)20-15(25)10-26-18-22-21-17(13-7-8-13)23(18)9-14(19)24/h4-6,13H,3,7-10H2,1-2H3,(H2,19,24)(H,20,25)