ethyl 2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate

Systemtic Name: ethyl 2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Openeye Name: ethyl 2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate CAS Name: 2-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Traditional Name: 2-[(4-pyrrolidinosulfonylbenzoyl)amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid ethyl ester Formula: C21H24N2O5S3 MolecularWeight: 480.62066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCS2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCS2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H24N2O5S3/c1-2-28-20(25)17-16-6-5-13-29-21(16)30-19(17)22-18(24)14-7-9-15(10-8-14)31(26,27)23-11-3-4-12-23/h7-10H,2-6,11-13H2,1H3,(H,22,24)