5-azanyl-1-(4-methylphenyl)-3-thiophen-2-ylcarbonyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(4-methylphenyl)-3-thiophen-2-ylcarbonyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(p-tolyl)-3-(thiophene-2-carbonyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(4-methylphenyl)-3-[oxo(thiophen-2-yl)methyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(4-methylphenyl)-3-(thiophene-2-carbonyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(p-tolyl)-3-(2-thenoyl)pyrazole-4-carbonitrile Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)C3=CC=CS3)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)C3=CC=CS3)C#N)N

InChI

InChI=1S/C16H12N4OS/c1-10-4-6-11(7-5-10)20-16(18)12(9-17)14(19-20)15(21)13-3-2-8-22-13/h2-8H,18H2,1H3