2-[1-[(2-azanyl-3-naphthalen-2-yl-propanoyl)amino]-2-naphthalen-2-yl-ethyl]-5-phenyl-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[1-[(2-azanyl-3-naphthalen-2-yl-propanoyl)amino]-2-naphthalen-2-yl-ethyl]-5-phenyl-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[1-[[2-amino-3-(2-naphthyl)propanoyl]amino]-2-(2-naphthyl)ethyl]-5-phenyl-thiazole-4-carboxylic acid CAS Name: 2-[1-[[2-amino-3-(2-naphthalenyl)-1-oxopropyl]amino]-2-(2-naphthalenyl)ethyl]-5-phenyl-4-thiazolecarboxylic acid IUPAC Name: 2-[1-[(2-amino-3-naphthalen-2-ylpropanoyl)amino]-2-naphthalen-2-ylethyl]-5-phenyl-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[1-[[2-amino-3-(2-naphthyl)propanoyl]amino]-2-(2-naphthyl)ethyl]-5-phenyl-thiazole-4-carboxylic acid Formula: C35H29N3O3S MolecularWeight: 571.68806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(S2)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C(CC5=CC6=CC=CC=C6C=C5)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(S2)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C(CC5=CC6=CC=CC=C6C=C5)N)C(=O)O

InChI

InChI=1S/C35H29N3O3S/c36-29(20-22-14-16-24-8-4-6-12-27(24)18-22)33(39)37-30(21-23-15-17-25-9-5-7-13-28(25)19-23)34-38-31(35(40)41)32(42-34)26-10-2-1-3-11-26/h1-19,29-30H,20-21,36H2,(H,37,39)(H,40,41)