1-methyl-5-(2-methylphenyl)sulfanyl-3-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 1-methyl-5-(2-methylphenyl)sulfanyl-3-phenyl-pyrazole-4-carbonitrile Openeye Name: 1-methyl-5-(o-tolylsulfanyl)-3-phenyl-pyrazole-4-carbonitrile CAS Name: 1-methyl-5-[(2-methylphenyl)thio]-3-phenyl-4-pyrazolecarbonitrile IUPAC Name: 1-methyl-5-(2-methylphenyl)sulfanyl-3-phenylpyrazole-4-carbonitrile Traditional Name: 1-methyl-5-(o-tolylthio)-3-phenyl-pyrazole-4-carbonitrile Formula: C18H15N3S MolecularWeight: 305.3968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2=C(C(=NN2C)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1SC2=C(C(=NN2C)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H15N3S/c1-13-8-6-7-11-16(13)22-18-15(12-19)17(20-21(18)2)14-9-4-3-5-10-14/h3-11H,1-2H3