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

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C25H25N3O4S2/c1-2-16-32-21-8-5-7-19(17-21)24(29)27-25(33)26-20-10-12-22(13-11-20)34(30,31)28-15-14-18-6-3-4-9-23(18)28/h3-13,17H,2,14-16H2,1H3,(H2,26,27,29,33)