(3R)-1-[C-methyl-N-(4-nitrophenyl)carbonimidoyl]pyrrolidine-3-thiol

Systemtic Name: (3R)-1-[C-methyl-N-(4-nitrophenyl)carbonimidoyl]pyrrolidine-3-thiol Openeye Name: (3R)-1-[C-methyl-N-(4-nitrophenyl)carbonimidoyl]pyrrolidine-3-thiol CAS Name: (3R)-1-[1-(4-nitrophenyl)iminoethyl]-3-pyrrolidinethiol IUPAC Name: (3R)-1-[C-methyl-N-(4-nitrophenyl)carbonimidoyl]pyrrolidine-3-thiol Traditional Name: (3R)-1-[C-methyl-N-(4-nitrophenyl)carbonimidoyl]pyrrolidine-3-thiol Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC=C(C=C1)[N+](=O)[O-])N2CCC(C2)S

Isomeric SMILES

CC(=NC1=CC=C(C=C1)[N+](=O)[O-])N2CC[C@H](C2)S

InChI

InChI=1S/C12H15N3O2S/c1-9(14-7-6-12(18)8-14)13-10-2-4-11(5-3-10)15(16)17/h2-5,12,18H,6-8H2,1H3/t12-/m1/s1