6-azanyl-3-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-(4-methoxyphenyl)-4-[4-(methylthio)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-(4-methoxyphenyl)-4-[4-(methylthio)phenyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)SC

InChI

InChI=1S/C21H18N4O2S/c1-26-14-7-3-13(4-8-14)19-18-17(12-5-9-15(28-2)10-6-12)16(11-22)20(23)27-21(18)25-24-19/h3-10,17H,23H2,1-2H3,(H,24,25)