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

Systemtic Name: 6-azanyl-4-(phenylmethyl)-3-(phenylsulfanylmethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-benzyl-3-(phenylsulfanylmethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(phenylmethyl)-3-[(phenylthio)methyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-benzyl-3-(phenylsulfanylmethyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-benzyl-3-[(phenylthio)methyl]-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H18N4OS MolecularWeight: 374.45882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=C(OC3=NNC(=C23)CSC4=CC=CC=C4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CC2C(=C(OC3=NNC(=C23)CSC4=CC=CC=C4)N)C#N

InChI

InChI=1S/C21H18N4OS/c22-12-17-16(11-14-7-3-1-4-8-14)19-18(24-25-21(19)26-20(17)23)13-27-15-9-5-2-6-10-15/h1-10,16H,11,13,23H2,(H,24,25)