6-azanyl-3-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]-4-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]-4-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C20H16N6OS2 MolecularWeight: 420.51064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CS4)C

InChI

InChI=1S/C20H16N6OS2/c1-10-6-11(2)24-20(12(10)7-21)29-9-14-17-16(15-4-3-5-28-15)13(8-22)18(23)27-19(17)26-25-14/h3-6,16H,9,23H2,1-2H3,(H,25,26)