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

Systemtic Name: 3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazole Openeye Name: 3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazole CAS Name: 3-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazole IUPAC Name: 3-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazole Traditional Name: 3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-4-cyclopropyl-5-pyrrolidino-1,2,4-triazole Formula: C20H23ClN6S MolecularWeight: 414.95482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(N2C3CC3)N4CCCC4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(N2C3CC3)N4CCCC4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C20H23ClN6S/c1-14-17(18(21)27(24-14)16-7-3-2-4-8-16)13-28-20-23-22-19(25-11-5-6-12-25)26(20)15-9-10-15/h2-4,7-8,15H,5-6,9-13H2,1H3