ethyl 3-(2-aminophenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate

Systemtic Name: ethyl 3-(2-aminophenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoate Openeye Name: ethyl 3-(2-aminophenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoate CAS Name: 3-[(2-aminophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-aminophenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoate Traditional Name: 3-[(2-aminophenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid ethyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)OC)SC2=CC=CC=C2N)O

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)OC)SC2=CC=CC=C2N)O

InChI

InChI=1S/C18H21NO4S/c1-3-23-18(21)16(20)17(12-8-10-13(22-2)11-9-12)24-15-7-5-4-6-14(15)19/h4-11,16-17,20H,3,19H2,1-2H3