O-[(3R,4S)-4-methyl-1-(phenylmethyl)pyrrolidin-3-yl] methylsulfanylmethanethioate

Systemtic Name: O-[(3R,4S)-4-methyl-1-(phenylmethyl)pyrrolidin-3-yl] methylsulfanylmethanethioate Openeye Name: O-[(3R,4S)-1-benzyl-4-methyl-pyrrolidin-3-yl] methylsulfanylmethanethioate CAS Name: (methylthio)methanethioic acid O-[(3R,4S)-4-methyl-1-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: O-[(3R,4S)-1-benzyl-4-methylpyrrolidin-3-yl] methylsulfanylmethanethioate Traditional Name: (methylthio)methanethioic acid O-[(3R,4S)-1-benzyl-4-methyl-pyrrolidin-3-yl] ester Formula: C14H19NOS2 MolecularWeight: 281.43676

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1OC(=S)SC)CC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CN(C[C@@H]1OC(=S)SC)CC2=CC=CC=C2

InChI

InChI=1S/C14H19NOS2/c1-11-8-15(9-12-6-4-3-5-7-12)10-13(11)16-14(17)18-2/h3-7,11,13H,8-10H2,1-2H3/t11-,13-/m0/s1