N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]cyclohexanecarboxamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3S2/c26-21(17-7-2-1-3-8-17)24-22(29)23-18-10-12-19(13-11-18)30(27,28)25-15-14-16-6-4-5-9-20(16)25/h4-6,9-13,17H,1-3,7-8,14-15H2,(H2,23,24,26,29)