6-azanyl-4-[4-methoxy-2-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-[4-methoxy-2-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-[4-methoxy-2-(2-pyridylsulfanylmethyl)phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-[4-methoxy-2-[(2-pyridinylthio)methyl]phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-[4-methoxy-2-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-[4-methoxy-2-[(2-pyridylthio)methyl]phenyl]-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C=C(C=C3)OC)CSC4=CC=CC=N4

Isomeric SMILES

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C=C(C=C3)OC)CSC4=CC=CC=N4

InChI

InChI=1S/C23H23N5O2S/c1-3-6-18-21-20(17(12-24)22(25)30-23(21)28-27-18)16-9-8-15(29-2)11-14(16)13-31-19-7-4-5-10-26-19/h4-5,7-11,20H,3,6,13,25H2,1-2H3,(H,27,28)