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

Systemtic Name: 5-(4-methylsulfanylphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]-3,4-dihydropyrazole-2-carbaldehyde Openeye Name: 5-(4-methylsulfanylphenyl)-3-[5-(4-nitrophenyl)-2-furyl]-3,4-dihydropyrazole-2-carbaldehyde CAS Name: 5-[4-(methylthio)phenyl]-3-[5-(4-nitrophenyl)-2-furanyl]-3,4-dihydropyrazole-2-carboxaldehyde IUPAC Name: 5-(4-methylsulfanylphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]-3,4-dihydropyrazole-2-carbaldehyde Traditional Name: 3-[4-(methylthio)phenyl]-5-[5-(4-nitrophenyl)-2-furyl]-2-pyrazoline-1-carbaldehyde Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])C=O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-])C=O

InChI

InChI=1S/C21H17N3O4S/c1-29-17-8-4-14(5-9-17)18-12-19(23(13-25)22-18)21-11-10-20(28-21)15-2-6-16(7-3-15)24(26)27/h2-11,13,19H,12H2,1H3