N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NCC(=O)NC2=C(C=C(C=C2)Br)C)C

InChI

InChI=1S/C20H23BrN2O2S/c1-13-4-6-17(11-14(13)2)26-9-8-19(24)22-12-20(25)23-18-7-5-16(21)10-15(18)3/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,24)(H,23,25)