4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C26H32N6O2S MolecularWeight: 492.63628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H32N6O2S/c1-26(2,3)20-12-10-19(11-13-20)23-28-29-25(30(23)4)35-18-22(33)31-14-16-32(17-15-31)24(34)27-21-8-6-5-7-9-21/h5-13H,14-18H2,1-4H3,(H,27,34)