[5-azanyl-1-[(4-methoxyphenyl)methyl]pyrazol-4-yl] thiocyanate

Systemtic Name: [5-azanyl-1-[(4-methoxyphenyl)methyl]pyrazol-4-yl] thiocyanate Openeye Name: [5-amino-1-[(4-methoxyphenyl)methyl]pyrazol-4-yl] thiocyanate CAS Name: thiocyanic acid [5-amino-1-[(4-methoxyphenyl)methyl]-4-pyrazolyl] ester IUPAC Name: [5-amino-1-[(4-methoxyphenyl)methyl]pyrazol-4-yl] thiocyanate Traditional Name: thiocyanic acid (5-amino-1-p-anisyl-pyrazol-4-yl) ester Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(C=N2)SC#N)N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(C=N2)SC#N)N

InChI

InChI=1S/C12H12N4OS/c1-17-10-4-2-9(3-5-10)7-16-12(14)11(6-15-16)18-8-13/h2-6H,7,14H2,1H3