2-[(5-chloranylthiophen-2-yl)carbonyl-[2-(naphthalen-1-ylcarbonylamino)-3-phenyl-propyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)carbonyl-[2-(naphthalen-1-ylcarbonylamino)-3-phenyl-propyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[(5-chlorothiophene-2-carbonyl)-[2-(naphthalene-1-carbonylamino)-3-phenyl-propyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(5-chloro-2-thiophenyl)-oxomethyl]-[2-[[1-naphthalenyl(oxo)methyl]amino]-3-phenylpropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(5-chlorothiophene-2-carbonyl)-[2-(naphthalene-1-carbonylamino)-3-phenylpropyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(5-chlorothiophene-2-carbonyl)-[2-(1-naphthoylamino)-3-phenyl-propyl]amino]-3-phenyl-propionic acid Formula: C34H29ClN2O4S MolecularWeight: 597.12306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=C(S3)Cl)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CC(CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC=C(S3)Cl)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C34H29ClN2O4S/c35-31-19-18-30(42-31)33(39)37(29(34(40)41)21-24-12-5-2-6-13-24)22-26(20-23-10-3-1-4-11-23)36-32(38)28-17-9-15-25-14-7-8-16-27(25)28/h1-19,26,29H,20-22H2,(H,36,38)(H,40,41)