2-[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[[2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetamide CAS Name: 2-[[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[[2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC(=O)NC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC(=O)NC(C)C)C3=CC=CC=C3

InChI

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