N-[1-(3-bromophenyl)ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-[1-(3-bromophenyl)ethyl]-2-[[2-(4-methylanilino)-2-oxoethyl]thio]propanamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-2-[[2-keto-2-(p-toluidino)ethyl]thio]propionamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC(C)C2=CC(=CC=C2)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC(C)C(=O)NC(C)C2=CC(=CC=C2)Br

InChI

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