methyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-(4-methoxy-3-morpholinosulfonyl-phenyl)acryloyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C22H26N2O7S2 MolecularWeight: 494.58104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C22H26N2O7S2/c1-14-15(2)32-21(20(14)22(26)30-4)23-19(25)8-6-16-5-7-17(29-3)18(13-16)33(27,28)24-9-11-31-12-10-24/h5-8,13H,9-12H2,1-4H3,(H,23,25)