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

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]hexanamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]hexanamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32

InChI

InChI=1S/C21H25N3O3S2/c1-2-3-4-9-20(25)23-21(28)22-17-10-12-18(13-11-17)29(26,27)24-15-14-16-7-5-6-8-19(16)24/h5-8,10-13H,2-4,9,14-15H2,1H3,(H2,22,23,25,28)