3-[3-(1-thiophen-2-ylsulfonylindol-3-yl)propanoylamino]benzamide

Systemtic Name: 3-[3-(1-thiophen-2-ylsulfonylindol-3-yl)propanoylamino]benzamide Openeye Name: 3-[3-[1-(2-thienylsulfonyl)indol-3-yl]propanoylamino]benzamide CAS Name: 3-[[1-oxo-3-(1-thiophen-2-ylsulfonyl-3-indolyl)propyl]amino]benzamide IUPAC Name: 3-[3-(1-thiophen-2-ylsulfonylindol-3-yl)propanoylamino]benzamide Traditional Name: 3-[3-[1-(2-thienylsulfonyl)indol-3-yl]propanoylamino]benzamide Formula: C22H19N3O4S2 MolecularWeight: 453.53396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2S(=O)(=O)C3=CC=CS3)CCC(=O)NC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2S(=O)(=O)C3=CC=CS3)CCC(=O)NC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C22H19N3O4S2/c23-22(27)15-5-3-6-17(13-15)24-20(26)11-10-16-14-25(19-8-2-1-7-18(16)19)31(28,29)21-9-4-12-30-21/h1-9,12-14H,10-11H2,(H2,23,27)(H,24,26)