2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-(3-phenylpropyl)acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-(3-phenylpropyl)acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-(3-phenylpropyl)acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-(3-phenylpropyl)acetamide Formula: C18H21BrN2O3S MolecularWeight: 425.33994

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCC1=CC=CC=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H21BrN2O3S/c1-25(23,24)21(17-11-9-16(19)10-12-17)14-18(22)20-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12H,5,8,13-14H2,1H3,(H,20,22)