S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-methyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-methyl-pyrrolidin-1-yl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-methyl-pyrrolidin-1-yl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-methyl-1-pyrrolidinyl]-2-oxoethyl] ester IUPAC Name: S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-4-methylpyrrolidin-1-yl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[3-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-4-methyl-pyrrolidino]-2-keto-ethyl] ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1C2=CC(=C(C=C2)OC)OCC3CC3)C(=O)CSC(=O)C

Isomeric SMILES

CC1CN(CC1C2=CC(=C(C=C2)OC)OCC3CC3)C(=O)CSC(=O)C

InChI

InChI=1S/C20H27NO4S/c1-13-9-21(20(23)12-26-14(2)22)10-17(13)16-6-7-18(24-3)19(8-16)25-11-15-4-5-15/h6-8,13,15,17H,4-5,9-12H2,1-3H3