N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-tosyl-propionamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C19H21BrN2O4S/c1-13-3-6-16(7-4-13)27(25,26)10-9-18(23)21-12-19(24)22-17-8-5-15(20)11-14(17)2/h3-8,11H,9-10,12H2,1-2H3,(H,21,23)(H,22,24)