N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide Openeye Name: N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-4-piperidyl]cyclopropanecarboxamide CAS Name: N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-4-piperidinyl]cyclopropanecarboxamide IUPAC Name: N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide Traditional Name: N-[1-[[3-(4-tert-butylphenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-4-piperidyl]cyclopropanecarboxamide Formula: C28H35N5OS MolecularWeight: 489.6754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)N2C3=CC=CC=C3)CN4CCC(CC4)NC(=O)C5CC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)N2C3=CC=CC=C3)CN4CCC(CC4)NC(=O)C5CC5

InChI

InChI=1S/C28H35N5OS/c1-28(2,3)22-13-11-20(12-14-22)25-30-32(27(35)33(25)24-7-5-4-6-8-24)19-31-17-15-23(16-18-31)29-26(34)21-9-10-21/h4-8,11-14,21,23H,9-10,15-19H2,1-3H3,(H,29,34)