2-[(4-bromanyl-1-propyl-pyrrol-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4-bromanyl-1-propyl-pyrrol-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(4-bromo-1-propyl-pyrrole-2-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(4-bromo-1-propyl-2-pyrrolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4-bromo-1-propylpyrrole-2-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(4-bromo-1-propyl-pyrrole-2-carbonyl)amino]-4-(methylthio)butyric acid Formula: C13H19BrN2O3S MolecularWeight: 363.27056

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)NC(CCSC)C(=O)O)Br

Isomeric SMILES

CCCN1C=C(C=C1C(=O)NC(CCSC)C(=O)O)Br

InChI

InChI=1S/C13H19BrN2O3S/c1-3-5-16-8-9(14)7-11(16)12(17)15-10(13(18)19)4-6-20-2/h7-8,10H,3-6H2,1-2H3,(H,15,17)(H,18,19)