methyl 2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C15H13Br2NO3S MolecularWeight: 447.14162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C15H13Br2NO3S/c1-21-15(20)11(7-9-5-3-2-4-6-9)18-14(19)12-8-10(16)13(17)22-12/h2-6,8,11H,7H2,1H3,(H,18,19)