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

Systemtic Name: 3-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-5-cyclopropyl-1,2,4-triazole CAS Name: 3-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-5-cyclopropyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-5-cyclopropyl-1,2,4-triazole Formula: C19H20ClN5S MolecularWeight: 385.9136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(N2CC=C)C3CC3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(N2CC=C)C3CC3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C19H20ClN5S/c1-3-11-24-18(14-9-10-14)21-22-19(24)26-12-16-13(2)23-25(17(16)20)15-7-5-4-6-8-15/h3-8,14H,1,9-12H2,2H3