5-azanyl-1-phenyl-3-(phenylmethylsulfanyl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-phenyl-3-(phenylmethylsulfanyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-3-benzylsulfanyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-phenyl-3-(phenylmethylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-benzylsulfanyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-(benzylthio)-1-phenyl-pyrazole-4-carbonitrile Formula: C17H14N4S MolecularWeight: 306.38486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C17H14N4S/c18-11-15-16(19)21(14-9-5-2-6-10-14)20-17(15)22-12-13-7-3-1-4-8-13/h1-10H,12,19H2