3-(4-bromophenyl)sulfonyl-N-[3-[ethyl-(phenylmethyl)amino]propyl]propanamide

Systemtic Name: 3-(4-bromophenyl)sulfonyl-N-[3-[ethyl-(phenylmethyl)amino]propyl]propanamide Openeye Name: N-[3-[benzyl(ethyl)amino]propyl]-3-(4-bromophenyl)sulfonyl-propanamide CAS Name: 3-(4-bromophenyl)sulfonyl-N-[3-[ethyl-(phenylmethyl)amino]propyl]propanamide IUPAC Name: N-[3-[benzyl(ethyl)amino]propyl]-3-(4-bromophenyl)sulfonylpropanamide Traditional Name: N-[3-[benzyl(ethyl)amino]propyl]-3-brosyl-propionamide Formula: C21H27BrN2O3S MolecularWeight: 467.41968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)Br)CC2=CC=CC=C2

Isomeric SMILES

CCN(CCCNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)Br)CC2=CC=CC=C2

InChI

InChI=1S/C21H27BrN2O3S/c1-2-24(17-18-7-4-3-5-8-18)15-6-14-23-21(25)13-16-28(26,27)20-11-9-19(22)10-12-20/h3-5,7-12H,2,6,13-17H2,1H3,(H,23,25)