N-[1-(4-tert-butylphenyl)ethyl]-2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-2-(5-chloro-N-mesyl-2-methyl-anilino)propionamide Formula: C23H31ClN2O3S MolecularWeight: 451.02184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NC(C)C2=CC=C(C=C2)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NC(C)C2=CC=C(C=C2)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C23H31ClN2O3S/c1-15-8-13-20(24)14-21(15)26(30(7,28)29)17(3)22(27)25-16(2)18-9-11-19(12-10-18)23(4,5)6/h8-14,16-17H,1-7H3,(H,25,27)