2-[[3,3-diphenylpropyl-[(4-phenylmethoxyphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[[3,3-diphenylpropyl-[(4-phenylmethoxyphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[[(4-benzyloxyphenyl)methyl-(3,3-diphenylpropyl)amino]methyl]thiazole-4-carboxylic acid CAS Name: 2-[[3,3-diphenylpropyl-[(4-phenylmethoxyphenyl)methyl]amino]methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[[3,3-diphenylpropyl-[(4-phenylmethoxyphenyl)methyl]amino]methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[[(4-benzoxybenzyl)-(3,3-diphenylpropyl)amino]methyl]thiazole-4-carboxylic acid Formula: C34H32N2O3S MolecularWeight: 548.69448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN(CCC(C3=CC=CC=C3)C4=CC=CC=C4)CC5=NC(=CS5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN(CCC(C3=CC=CC=C3)C4=CC=CC=C4)CC5=NC(=CS5)C(=O)O

InChI

InChI=1S/C34H32N2O3S/c37-34(38)32-25-40-33(35-32)23-36(21-20-31(28-12-6-2-7-13-28)29-14-8-3-9-15-29)22-26-16-18-30(19-17-26)39-24-27-10-4-1-5-11-27/h1-19,25,31H,20-24H2,(H,37,38)