3-[4-(1-thiophen-2-ylsulfonylindol-3-yl)butanoylamino]benzamide

Systemtic Name: 3-[4-(1-thiophen-2-ylsulfonylindol-3-yl)butanoylamino]benzamide Openeye Name: 3-[4-[1-(2-thienylsulfonyl)indol-3-yl]butanoylamino]benzamide CAS Name: 3-[[1-oxo-4-(1-thiophen-2-ylsulfonyl-3-indolyl)butyl]amino]benzamide IUPAC Name: 3-[4-(1-thiophen-2-ylsulfonylindol-3-yl)butanoylamino]benzamide Traditional Name: 3-[4-[1-(2-thienylsulfonyl)indol-3-yl]butanoylamino]benzamide Formula: C23H21N3O4S2 MolecularWeight: 467.56054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3O4S2/c24-23(28)16-6-3-8-18(14-16)25-21(27)11-4-7-17-15-26(20-10-2-1-9-19(17)20)32(29,30)22-12-5-13-31-22/h1-3,5-6,8-10,12-15H,4,7,11H2,(H2,24,28)(H,25,27)