[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 5-morpholin-4-yl-4-phenyl-thiophene-2-carboxylate

Systemtic Name: [2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 5-morpholin-4-yl-4-phenyl-thiophene-2-carboxylate Openeye Name: [2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl] 5-morpholino-4-phenyl-thiophene-2-carboxylate CAS Name: 5-(4-morpholinyl)-4-phenyl-2-thiophenecarboxylic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 5-morpholin-4-yl-4-phenylthiophene-2-carboxylate Traditional Name: 5-morpholino-4-phenyl-thiophene-2-carboxylic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C22H20ClN3O4S MolecularWeight: 457.9299

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(S2)C(=O)OCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=C(C=C(S2)C(=O)OCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O4S/c23-16-6-7-19(24-13-16)25-20(27)14-30-22(28)18-12-17(15-4-2-1-3-5-15)21(31-18)26-8-10-29-11-9-26/h1-7,12-13H,8-11,14H2,(H,24,25,27)