1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenylsulfanyl-propan-1-one Openeye Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenylsulfanyl-propan-1-one CAS Name: 1-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-(phenylthio)-1-propanone IUPAC Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenylsulfanylpropan-1-one Traditional Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidino]-2-(phenylthio)propan-1-one Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C2=C(C=C(C=C2)OC)OC)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCCC1C2=C(C=C(C=C2)OC)OC)SC3=CC=CC=C3

InChI

InChI=1S/C21H25NO3S/c1-15(26-17-8-5-4-6-9-17)21(23)22-13-7-10-19(22)18-12-11-16(24-2)14-20(18)25-3/h4-6,8-9,11-12,14-15,19H,7,10,13H2,1-3H3