N-(1-cyclohexylpyrrolidin-3-yl)-N-methyl-4-nitro-benzenecarbothioamide

Systemtic Name: N-(1-cyclohexylpyrrolidin-3-yl)-N-methyl-4-nitro-benzenecarbothioamide Openeye Name: N-(1-cyclohexylpyrrolidin-3-yl)-N-methyl-4-nitro-benzenecarbothioamide CAS Name: N-(1-cyclohexyl-3-pyrrolidinyl)-N-methyl-4-nitrobenzenecarbothioamide IUPAC Name: N-(1-cyclohexylpyrrolidin-3-yl)-N-methyl-4-nitrobenzenecarbothioamide Traditional Name: N-(1-cyclohexylpyrrolidin-3-yl)-N-methyl-4-nitro-thiobenzamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)C2CCCCC2)C(=S)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCN(C1)C2CCCCC2)C(=S)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O2S/c1-19(18(24)14-7-9-16(10-8-14)21(22)23)17-11-12-20(13-17)15-5-3-2-4-6-15/h7-10,15,17H,2-6,11-13H2,1H3