4-bromanyl-N-butyl-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide

Systemtic Name: 4-bromanyl-N-butyl-N-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide Openeye Name: N-[2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-4-bromo-N-butyl-benzamide CAS Name: 4-bromo-N-butyl-N-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]benzamide IUPAC Name: N-[2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-bromo-N-butylbenzamide Traditional Name: N-[2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-4-bromo-N-butyl-benzamide Formula: C25H27BrN2O2S MolecularWeight: 499.46308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H27BrN2O2S/c1-2-3-15-27(25(30)21-11-13-22(26)14-12-21)19-24(29)28(18-23-10-7-16-31-23)17-20-8-5-4-6-9-20/h4-14,16H,2-3,15,17-19H2,1H3