methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfinate

Systemtic Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfinate Openeye Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfinate CAS Name: 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfinic acid methyl ester IUPAC Name: methyl 4-[5-(4-chlorophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfinate Traditional Name: 4-[3-(4-chlorophenyl)-2-pyrazolin-1-yl]benzenesulfinic acid methyl ester Formula: C16H15ClN2O2S MolecularWeight: 334.8205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COS(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COS(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN2O2S/c1-21-22(20)15-8-6-14(7-9-15)19-11-10-16(18-19)12-2-4-13(17)5-3-12/h2-9H,10-11H2,1H3