2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C18H21BrN2O3S2 MolecularWeight: 457.40494

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCSC1=CC=CC=C1)C2=CC(=CC=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCSC1=CC=CC=C1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H21BrN2O3S2/c1-26(23,24)21(16-8-5-7-15(19)13-16)14-18(22)20-11-6-12-25-17-9-3-2-4-10-17/h2-5,7-10,13H,6,11-12,14H2,1H3,(H,20,22)