O4-ethyl O1-methyl 2-methyl-3-phenethyl-2-[(4-phenylphenyl)-[2-(thiophen-2-ylamino)propanoyl]amino]butanedioate

Systemtic Name: O4-ethyl O1-methyl 2-methyl-3-phenethyl-2-[(4-phenylphenyl)-[2-(thiophen-2-ylamino)propanoyl]amino]butanedioate Openeye Name: O4-ethyl O1-methyl 2-methyl-3-phenethyl-2-[4-phenyl-N-[2-(2-thienylamino)propanoyl]anilino]butanedioate CAS Name: 2-methyl-2-(N-[1-oxo-2-(thiophen-2-ylamino)propyl]-4-phenylanilino)-3-phenethylbutanedioic acid O4-ethyl ester O1-methyl ester IUPAC Name: 4-O-ethyl 1-O-methyl 2-methyl-3-phenethyl-2-[4-phenyl-N-[2-(thiophen-2-ylamino)propanoyl]anilino]butanedioate Traditional Name: 2-methyl-3-phenethyl-2-[4-phenyl-N-[2-(2-thienylamino)propanoyl]anilino]succinic acid O4-ethyl ester O1-methyl ester Formula: C35H38N2O5S MolecularWeight: 598.75162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)C(C)(C(=O)OC)N(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C(C)NC4=CC=CS4

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)C(C)(C(=O)OC)N(C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)C(C)NC4=CC=CS4

InChI

InChI=1S/C35H38N2O5S/c1-5-42-33(39)30(23-18-26-13-8-6-9-14-26)35(3,34(40)41-4)37(32(38)25(2)36-31-17-12-24-43-31)29-21-19-28(20-22-29)27-15-10-7-11-16-27/h6-17,19-22,24-25,30,36H,5,18,23H2,1-4H3