5-azanyl-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(2-chlorophenyl)methylthio]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[(2-chlorophenyl)methylsulfanyl]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(2-chlorobenzyl)thio]-1H-pyrazole-4-carbonitrile Formula: C11H9ClN4S MolecularWeight: 264.73396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=C2C#N)N)Cl

InChI

InChI=1S/C11H9ClN4S/c12-9-4-2-1-3-7(9)6-17-11-8(5-13)10(14)15-16-11/h1-4H,6H2,(H3,14,15,16)