methyl 2-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(2-ketopyrrolidino)-3-methyl-phenyl]sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)N4CCCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)N4CCCC4=O

InChI

InChI=1S/C21H24N2O5S2/c1-13-12-14(9-10-16(13)23-11-5-8-18(23)24)30(26,27)22-20-19(21(25)28-2)15-6-3-4-7-17(15)29-20/h9-10,12,22H,3-8,11H2,1-2H3