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

Systemtic Name: ethyl 2-[4-(1-thiophen-2-ylsulfonylindol-3-yl)butanoylamino]ethanoate Openeye Name: ethyl 2-[4-[1-(2-thienylsulfonyl)indol-3-yl]butanoylamino]acetate CAS Name: 2-[[1-oxo-4-(1-thiophen-2-ylsulfonyl-3-indolyl)butyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(1-thiophen-2-ylsulfonylindol-3-yl)butanoylamino]acetate Traditional Name: 2-[4-[1-(2-thienylsulfonyl)indol-3-yl]butanoylamino]acetic acid ethyl ester Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CCCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)CNC(=O)CCCC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N2O5S2/c1-2-27-19(24)13-21-18(23)10-5-7-15-14-22(17-9-4-3-8-16(15)17)29(25,26)20-11-6-12-28-20/h3-4,6,8-9,11-12,14H,2,5,7,10,13H2,1H3,(H,21,23)