ethyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[3-(4-methoxy-3-morpholinosulfonyl-phenyl)acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H25N3O7S2 MolecularWeight: 495.5691

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O7S2/c1-4-31-20(26)19-14(2)22-21(32-19)23-18(25)8-6-15-5-7-16(29-3)17(13-15)33(27,28)24-9-11-30-12-10-24/h5-8,13H,4,9-12H2,1-3H3,(H,22,23,25)