3-[2-(2-dimethylaminoethylamino)phenyl]sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanamide

Systemtic Name: 3-[2-(2-dimethylaminoethylamino)phenyl]sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanamide Openeye Name: 3-[2-(2-dimethylaminoethylamino)phenyl]sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanamide CAS Name: 3-[[2-(2-dimethylaminoethylamino)phenyl]thio]-2-hydroxy-3-(4-methoxyphenyl)propanamide IUPAC Name: 3-[2-(2-dimethylaminoethylamino)phenyl]sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanamide Traditional Name: 3-[[2-(2-dimethylaminoethylamino)phenyl]thio]-2-hydroxy-3-(4-methoxyphenyl)propionamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC=CC=C1SC(C2=CC=C(C=C2)OC)C(C(=O)N)O

Isomeric SMILES

CN(C)CCNC1=CC=CC=C1SC(C2=CC=C(C=C2)OC)C(C(=O)N)O

InChI

InChI=1S/C20H27N3O3S/c1-23(2)13-12-22-16-6-4-5-7-17(16)27-19(18(24)20(21)25)14-8-10-15(26-3)11-9-14/h4-11,18-19,22,24H,12-13H2,1-3H3,(H2,21,25)