2-[2-bromanylethanoyl(thiophen-2-ylmethyl)amino]-N-(2-oxidanylideneheptan-3-yl)-3-phenyl-propanamide

Systemtic Name: 2-[2-bromanylethanoyl(thiophen-2-ylmethyl)amino]-N-(2-oxidanylideneheptan-3-yl)-3-phenyl-propanamide Openeye Name: N-(1-acetylpentyl)-2-[(2-bromoacetyl)-(2-thienylmethyl)amino]-3-phenyl-propanamide CAS Name: 2-[(2-bromo-1-oxoethyl)-(thiophen-2-ylmethyl)amino]-N-(2-oxoheptan-3-yl)-3-phenylpropanamide IUPAC Name: 2-[(2-bromoacetyl)-(thiophen-2-ylmethyl)amino]-N-(2-oxoheptan-3-yl)-3-phenylpropanamide Traditional Name: N-(1-acetylpentyl)-2-[(2-bromoacetyl)-(2-thenyl)amino]-3-phenyl-propionamide Formula: C23H29BrN2O3S MolecularWeight: 493.45696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C)NC(=O)C(CC1=CC=CC=C1)N(CC2=CC=CS2)C(=O)CBr

Isomeric SMILES

CCCCC(C(=O)C)NC(=O)C(CC1=CC=CC=C1)N(CC2=CC=CS2)C(=O)CBr

InChI

InChI=1S/C23H29BrN2O3S/c1-3-4-12-20(17(2)27)25-23(29)21(14-18-9-6-5-7-10-18)26(22(28)15-24)16-19-11-8-13-30-19/h5-11,13,20-21H,3-4,12,14-16H2,1-2H3,(H,25,29)