N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[4-(1-pyrrolidinylsulfonyl)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(4-pyrrolidinosulfonylphenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H25N3O3S2/c22-17(14-6-2-1-3-7-14)20-18(25)19-15-8-10-16(11-9-15)26(23,24)21-12-4-5-13-21/h8-11,14H,1-7,12-13H2,(H2,19,20,22,25)