2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(4-iodophenyl)propanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(4-iodophenyl)propanamide Openeye Name: 2-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-(4-iodophenyl)propanamide CAS Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-(4-iodophenyl)propanamide IUPAC Name: 2-(3,4-dimethyl-N-methylsulfonylanilino)-N-(4-iodophenyl)propanamide Traditional Name: N-(4-iodophenyl)-2-(N-mesyl-3,4-dimethyl-anilino)propionamide Formula: C18H21IN2O3S MolecularWeight: 472.34041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)I)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C(C)C(=O)NC2=CC=C(C=C2)I)S(=O)(=O)C)C

InChI

InChI=1S/C18H21IN2O3S/c1-12-5-10-17(11-13(12)2)21(25(4,23)24)14(3)18(22)20-16-8-6-15(19)7-9-16/h5-11,14H,1-4H3,(H,20,22)