ethyl 5-azanyl-4-cyano-3-[(3-morpholin-4-ylsulfonylphenyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(3-morpholin-4-ylsulfonylphenyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(3-morpholinosulfonylbenzoyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(3-morpholin-4-ylsulfonylbenzoyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(3-morpholinosulfonylbenzoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H21N3O7S2 MolecularWeight: 479.52664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H21N3O7S2/c1-2-29-20(25)17-16(15(11-21)18(22)31-17)12-30-19(24)13-4-3-5-14(10-13)32(26,27)23-6-8-28-9-7-23/h3-5,10H,2,6-9,12,22H2,1H3