3-[5-(4-chlorophenyl)furan-2-yl]-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazole-2-carbaldehyde

Systemtic Name: 3-[5-(4-chlorophenyl)furan-2-yl]-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazole-2-carbaldehyde Openeye Name: 3-[5-(4-chlorophenyl)-2-furyl]-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazole-2-carbaldehyde CAS Name: 3-[5-(4-chlorophenyl)-2-furanyl]-5-[4-(methylthio)phenyl]-3,4-dihydropyrazole-2-carboxaldehyde IUPAC Name: 3-[5-(4-chlorophenyl)furan-2-yl]-5-(4-methylsulfanylphenyl)-3,4-dihydropyrazole-2-carbaldehyde Traditional Name: 5-[5-(4-chlorophenyl)-2-furyl]-3-[4-(methylthio)phenyl]-2-pyrazoline-1-carbaldehyde Formula: C21H17ClN2O2S MolecularWeight: 396.88988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(O3)C4=CC=C(C=C4)Cl)C=O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(O3)C4=CC=C(C=C4)Cl)C=O

InChI

InChI=1S/C21H17ClN2O2S/c1-27-17-8-4-14(5-9-17)18-12-19(24(13-25)23-18)21-11-10-20(26-21)15-2-6-16(22)7-3-15/h2-11,13,19H,12H2,1H3