1-(5-chloranyl-2-methyl-phenyl)-4-(4-propan-2-yloxyphenyl)sulfonyl-piperazine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-(4-propan-2-yloxyphenyl)sulfonyl-piperazine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-(4-isopropoxyphenyl)sulfonyl-piperazine CAS Name: 1-(5-chloro-2-methylphenyl)-4-(4-propan-2-yloxyphenyl)sulfonylpiperazine IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-(4-propan-2-yloxyphenyl)sulfonylpiperazine Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-(4-isopropoxyphenyl)sulfonyl-piperazine Formula: C20H25ClN2O3S MolecularWeight: 408.9421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C20H25ClN2O3S/c1-15(2)26-18-6-8-19(9-7-18)27(24,25)23-12-10-22(11-13-23)20-14-17(21)5-4-16(20)3/h4-9,14-15H,10-13H2,1-3H3