3-(3-chlorophenyl)-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole; N-methylmethanamine

Systemtic Name: 3-(3-chlorophenyl)-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole; N-methylmethanamine Openeye Name: 3-(3-chlorophenyl)-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole; N-methylmethanamine CAS Name: 3-(3-chlorophenyl)-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole; N-methylmethanamine IUPAC Name: 3-(3-chlorophenyl)-5-methyl-2-(4-methylsulfonylphenyl)-1H-pyrrole; N-methylmethanamine Traditional Name: 3-(3-chlorophenyl)-2-(4-mesylphenyl)-5-methyl-1H-pyrrole; dimethylamine Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)Cl.CNC

Isomeric SMILES

CC1=CC(=C(N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)Cl.CNC

InChI

InChI=1S/C18H16ClNO2S.C2H7N/c1-12-10-17(14-4-3-5-15(19)11-14)18(20-12)13-6-8-16(9-7-13)23(2,21)22;1-3-2/h3-11,20H,1-2H3;3H,1-2H3