ethyl 3-methyl-5-[3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[3-(4-morpholinosulfonylphenyl)prop-2-enoylamino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[3-[4-(4-morpholinylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoylamino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[3-(4-morpholinosulfonylphenyl)acryloyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H24N2O6S2/c1-3-29-21(25)20-15(2)14-19(30-20)22-18(24)9-6-16-4-7-17(8-5-16)31(26,27)23-10-12-28-13-11-23/h4-9,14H,3,10-13H2,1-2H3,(H,22,24)