2-[[2-methyl-4-(1-naphthalen-1-ylethylcarbamoyl)phenyl]carbonylamino]-3-(thiophen-2-ylcarbonylamino)propanoic acid

Systemtic Name: 2-[[2-methyl-4-(1-naphthalen-1-ylethylcarbamoyl)phenyl]carbonylamino]-3-(thiophen-2-ylcarbonylamino)propanoic acid Openeye Name: 2-[[2-methyl-4-[1-(1-naphthyl)ethylcarbamoyl]benzoyl]amino]-3-(thiophene-2-carbonylamino)propanoic acid CAS Name: 2-[[[2-methyl-4-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]phenyl]-oxomethyl]amino]-3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid IUPAC Name: 2-[[2-methyl-4-(1-naphthalen-1-ylethylcarbamoyl)benzoyl]amino]-3-(thiophene-2-carbonylamino)propanoic acid Traditional Name: 2-[[2-methyl-4-[1-(1-naphthyl)ethylcarbamoyl]benzoyl]amino]-3-(2-thenoylamino)propionic acid Formula: C29H27N3O5S MolecularWeight: 529.60678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(C)C2=CC=CC3=CC=CC=C32)C(=O)NC(CNC(=O)C4=CC=CS4)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(C)C2=CC=CC3=CC=CC=C32)C(=O)NC(CNC(=O)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C29H27N3O5S/c1-17-15-20(26(33)31-18(2)22-10-5-8-19-7-3-4-9-23(19)22)12-13-21(17)27(34)32-24(29(36)37)16-30-28(35)25-11-6-14-38-25/h3-15,18,24H,16H2,1-2H3,(H,30,35)(H,31,33)(H,32,34)(H,36,37)