(3S)-1-(4-prop-1-ynoxyphenyl)sulfonylpyrrolidine-3-thiol

Systemtic Name: (3S)-1-(4-prop-1-ynoxyphenyl)sulfonylpyrrolidine-3-thiol Openeye Name: (3S)-1-(4-prop-1-ynoxyphenyl)sulfonylpyrrolidine-3-thiol CAS Name: (3S)-1-(4-prop-1-ynoxyphenyl)sulfonyl-3-pyrrolidinethiol IUPAC Name: (3S)-1-(4-prop-1-ynoxyphenyl)sulfonylpyrrolidine-3-thiol Traditional Name: (3S)-1-(4-prop-1-ynoxyphenyl)sulfonylpyrrolidine-3-thiol Formula: C13H15NO3S2 MolecularWeight: 297.3931

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Descriptors Computed from Structure

Canonical SMILES:

CC#COC1=CC=C(C=C1)S(=O)(=O)N2CCC(C2)S

Isomeric SMILES

CC#COC1=CC=C(C=C1)S(=O)(=O)N2CC[C@@H](C2)S

InChI

InChI=1S/C13H15NO3S2/c1-2-9-17-11-3-5-13(6-4-11)19(15,16)14-8-7-12(18)10-14/h3-6,12,18H,7-8,10H2,1H3/t12-/m0/s1