ethyl 3-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-[(4-morpholinosulfonylbenzoyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylate CAS Name: 3-[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-5-(3-nitrophenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylate Traditional Name: 3-[(4-morpholinosulfonylbenzoyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid ethyl ester Formula: C24H23N3O8S2 MolecularWeight: 545.58472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H23N3O8S2/c1-2-35-24(29)22-20(15-21(36-22)17-4-3-5-18(14-17)27(30)31)25-23(28)16-6-8-19(9-7-16)37(32,33)26-10-12-34-13-11-26/h3-9,14-15H,2,10-13H2,1H3,(H,25,28)