1-[5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine

Systemtic Name: 1-[5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Openeye Name: 1-[5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine CAS Name: 1-[5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine IUPAC Name: 1-[5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Traditional Name: 1-[5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]piperidine Formula: C21H25ClN6S MolecularWeight: 428.9814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(N2C3CC3)N4CCCCC4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(N2C3CC3)N4CCCCC4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C21H25ClN6S/c1-15-18(19(22)28(25-15)17-8-4-2-5-9-17)14-29-21-24-23-20(27(21)16-10-11-16)26-12-6-3-7-13-26/h2,4-5,8-9,16H,3,6-7,10-14H2,1H3