ethyl 2-[4-[3-[(2-ethoxyphenyl)carbamoyl-phenethyl-amino]phenyl]sulfanylphenyl]ethanoate

Systemtic Name: ethyl 2-[4-[3-[(2-ethoxyphenyl)carbamoyl-phenethyl-amino]phenyl]sulfanylphenyl]ethanoate Openeye Name: ethyl 2-[4-[3-[(2-ethoxyphenyl)carbamoyl-phenethyl-amino]phenyl]sulfanylphenyl]acetate CAS Name: 2-[4-[[3-[[(2-ethoxyanilino)-oxomethyl]-phenethylamino]phenyl]thio]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-[(2-ethoxyphenyl)carbamoyl-phenethylamino]phenyl]sulfanylphenyl]acetate Traditional Name: 2-[4-[[3-[o-phenetylcarbamoyl(phenethyl)amino]phenyl]thio]phenyl]acetic acid ethyl ester Formula: C33H34N2O4S MolecularWeight: 554.69906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N(CCC2=CC=CC=C2)C3=CC(=CC=C3)SC4=CC=C(C=C4)CC(=O)OCC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N(CCC2=CC=CC=C2)C3=CC(=CC=C3)SC4=CC=C(C=C4)CC(=O)OCC

InChI

InChI=1S/C33H34N2O4S/c1-3-38-31-16-9-8-15-30(31)34-33(37)35(22-21-25-11-6-5-7-12-25)27-13-10-14-29(24-27)40-28-19-17-26(18-20-28)23-32(36)39-4-2/h5-20,24H,3-4,21-23H2,1-2H3,(H,34,37)