5-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSC2=NC=CN2C3CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C#N)CSC2=NC=CN2C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C18H17N5S/c1-13-16(11-19)17(23(21-13)15-5-3-2-4-6-15)12-24-18-20-9-10-22(18)14-7-8-14/h2-6,9-10,14H,7-8,12H2,1H3