2-[2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-tert-butyl-ethanamide

Systemtic Name: 2-[2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-tert-butyl-ethanamide Openeye Name: 2-[[2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methyl-amino]-N-tert-butyl-acetamide CAS Name: 2-[[2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-methylamino]-N-tert-butylacetamide IUPAC Name: 2-[[2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methylamino]-N-tert-butylacetamide Traditional Name: 2-[[2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]-methyl-amino]-N-tert-butyl-acetamide Formula: C18H26N6O2S MolecularWeight: 390.50304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)N(C)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)N(C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C18H26N6O2S/c1-12-6-8-13(9-7-12)16-21-22-17(24(16)19)27-11-15(26)23(5)10-14(25)20-18(2,3)4/h6-9H,10-11,19H2,1-5H3,(H,20,25)