2-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[3-[4-(diethylsulfamoyl)phenyl]-1-oxoprop-2-enyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[3-[4-(diethylsulfamoyl)phenyl]prop-2-enoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[3-[4-(diethylsulfamoyl)phenyl]acryloyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

InChI

InChI=1S/C22H27N3O4S2/c1-3-25(4-2)31(28,29)16-12-9-15(10-13-16)11-14-19(26)24-22-20(21(23)27)17-7-5-6-8-18(17)30-22/h9-14H,3-8H2,1-2H3,(H2,23,27)(H,24,26)