2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]propanamide

Systemtic Name: 2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]propanamide Openeye Name: 2-(4-chloro-N-methylsulfonyl-anilino)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]propanamide CAS Name: 2-(4-chloro-N-methylsulfonylanilino)-N-[1-(4-methoxyphenyl)-3-methylbutyl]propanamide IUPAC Name: 2-(4-chloro-N-methylsulfonylanilino)-N-[1-(4-methoxyphenyl)-3-methylbutyl]propanamide Traditional Name: 2-(4-chloro-N-mesyl-anilino)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]propionamide Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C(C)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C(C)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H29ClN2O4S/c1-15(2)14-21(17-6-12-20(29-4)13-7-17)24-22(26)16(3)25(30(5,27)28)19-10-8-18(23)9-11-19/h6-13,15-16,21H,14H2,1-5H3,(H,24,26)