2-phenylmethoxyethyl N-[3-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)-4-(2-phenylmethoxyethoxycarbonylamino)phenyl]sulfanyl-phenyl]carbamate

Systemtic Name: 2-phenylmethoxyethyl N-[3-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)-4-(2-phenylmethoxyethoxycarbonylamino)phenyl]sulfanyl-phenyl]carbamate Openeye Name: 2-benzyloxyethyl N-[4-[4-(2-benzyloxyethoxycarbonylamino)-2-(4-hydroxyphenyl)phenyl]sulfanyl-3-(4-hydroxyphenyl)phenyl]carbamate CAS Name: N-[3-(4-hydroxyphenyl)-4-[[2-(4-hydroxyphenyl)-4-[[oxo(2-phenylmethoxyethoxy)methyl]amino]phenyl]thio]phenyl]carbamic acid 2-phenylmethoxyethyl ester IUPAC Name: 2-phenylmethoxyethyl N-[3-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)-4-(2-phenylmethoxyethoxycarbonylamino)phenyl]sulfanylphenyl]carbamate Traditional Name: N-[4-[[4-(2-benzoxyethoxycarbonylamino)-2-(4-hydroxyphenyl)phenyl]thio]-3-(4-hydroxyphenyl)phenyl]carbamic acid 2-benzoxyethyl ester Formula: C44H40N2O8S MolecularWeight: 756.862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCOC(=O)NC2=CC(=C(C=C2)SC3=C(C=C(C=C3)NC(=O)OCCOCC4=CC=CC=C4)C5=CC=C(C=C5)O)C6=CC=C(C=C6)O

Isomeric SMILES

C1=CC=C(C=C1)COCCOC(=O)NC2=CC(=C(C=C2)SC3=C(C=C(C=C3)NC(=O)OCCOCC4=CC=CC=C4)C5=CC=C(C=C5)O)C6=CC=C(C=C6)O

InChI

InChI=1S/C44H40N2O8S/c47-37-17-11-33(12-18-37)39-27-35(45-43(49)53-25-23-51-29-31-7-3-1-4-8-31)15-21-41(39)55-42-22-16-36(28-40(42)34-13-19-38(48)20-14-34)46-44(50)54-26-24-52-30-32-9-5-2-6-10-32/h1-22,27-28,47-48H,23-26,29-30H2,(H,45,49)(H,46,50)