N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N6OS/c1-29-21-25-24-19(27(21)18-10-5-6-11-18)12-7-13-22-20(28)16-14-23-26(15-16)17-8-3-2-4-9-17/h2-4,8-9,14-15,18H,5-7,10-13H2,1H3,(H,22,28)