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

Systemtic Name: ethyl 2-[4-[3-[phenethyl-[(2-phenoxyphenyl)carbamoyl]amino]phenyl]sulfanylphenyl]ethanoate Openeye Name: ethyl 2-[4-[3-[phenethyl-[(2-phenoxyphenyl)carbamoyl]amino]phenyl]sulfanylphenyl]acetate CAS Name: 2-[4-[[3-[[oxo-(2-phenoxyanilino)methyl]-phenethylamino]phenyl]thio]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-[phenethyl-[(2-phenoxyphenyl)carbamoyl]amino]phenyl]sulfanylphenyl]acetate Traditional Name: 2-[4-[[3-[phenethyl-[(2-phenoxyphenyl)carbamoyl]amino]phenyl]thio]phenyl]acetic acid ethyl ester Formula: C37H34N2O4S MolecularWeight: 602.74186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)SC2=CC=CC(=C2)N(CCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4OC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)SC2=CC=CC(=C2)N(CCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4OC5=CC=CC=C5

InChI

InChI=1S/C37H34N2O4S/c1-2-42-36(40)26-29-20-22-32(23-21-29)44-33-17-11-14-30(27-33)39(25-24-28-12-5-3-6-13-28)37(41)38-34-18-9-10-19-35(34)43-31-15-7-4-8-16-31/h3-23,27H,2,24-26H2,1H3,(H,38,41)