N-[1-[5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide

Systemtic Name: N-[1-[5-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide Openeye Name: N-[1-[4-allyl-5-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide CAS Name: N-[1-[5-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-methylbenzamide IUPAC Name: N-[1-[5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-methylbenzamide Traditional Name: N-[1-[4-allyl-5-[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide Formula: C26H31N5O2S MolecularWeight: 477.62164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3C)C

InChI

InChI=1S/C26H31N5O2S/c1-6-15-31-24(19(5)27-25(33)21-14-9-8-11-17(21)3)29-30-26(31)34-16-22(32)28-23-18(4)12-10-13-20(23)7-2/h6,8-14,19H,1,7,15-16H2,2-5H3,(H,27,33)(H,28,32)