6-azanyl-4-(3-methoxy-4-propan-2-yloxy-phenyl)-3-[(4-methylphenyl)sulfanylmethyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(3-methoxy-4-propan-2-yloxy-phenyl)-3-[(4-methylphenyl)sulfanylmethyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(4-isopropoxy-3-methoxy-phenyl)-3-(p-tolylsulfanylmethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-methoxy-4-propan-2-yloxyphenyl)-3-[[(4-methylphenyl)thio]methyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-methoxy-4-propan-2-yloxyphenyl)-3-[(4-methylphenyl)sulfanylmethyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(4-isopropoxy-3-methoxy-phenyl)-3-[(p-tolylthio)methyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C=C4)OC(C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C=C4)OC(C)C)OC

InChI

InChI=1S/C25H26N4O3S/c1-14(2)31-20-10-7-16(11-21(20)30-4)22-18(12-26)24(27)32-25-23(22)19(28-29-25)13-33-17-8-5-15(3)6-9-17/h5-11,14,22H,13,27H2,1-4H3,(H,28,29)