N-(2-diethylaminoethyl)-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-1,1-bis(oxidanylidene)-3-(phenylsulfonyl)-2,3-dihydro-1-benzothiophene-4-carboxamide Openeye Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-1,1-dioxo-2,3-dihydrobenzothiophene-4-carboxamide CAS Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-1,1-dioxo-2,3-dihydro-1-benzothiophene-4-carboxamide IUPAC Name: 3-(benzenesulfonyl)-N-(2-diethylaminoethyl)-1,1-dioxo-2,3-dihydro-1-benzothiophene-4-carboxamide Traditional Name: 3-besyl-N-(2-diethylaminoethyl)-1,1-diketo-2,3-dihydrobenzothiophene-4-carboxamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C2C(CS(=O)(=O)C2=CC=C1)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C2C(CS(=O)(=O)C2=CC=C1)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S2/c1-3-23(4-2)14-13-22-21(24)17-11-8-12-18-20(17)19(15-29(18,25)26)30(27,28)16-9-6-5-7-10-16/h5-12,19H,3-4,13-15H2,1-2H3,(H,22,24)