4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethylpyrazol-1-yl)-5-morpholin-4-yl-thiophene-2-carboxamide

Systemtic Name: 4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethylpyrazol-1-yl)-5-morpholin-4-yl-thiophene-2-carboxamide Openeye Name: 4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethylpyrazol-1-yl)-5-morpholino-thiophene-2-carboxamide CAS Name: 4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethyl-1-pyrazolyl)-5-(4-morpholinyl)-2-thiophenecarboxamide IUPAC Name: 4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethylpyrazol-1-yl)-5-morpholin-4-ylthiophene-2-carboxamide Traditional Name: 4-cyano-3-(2,4-dichlorophenyl)-N-(3,5-dimethylpyrazol-1-yl)-5-morpholino-thiophene-2-carboxamide Formula: C21H19Cl2N5O2S MolecularWeight: 476.37886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1NC(=O)C2=C(C(=C(S2)N3CCOCC3)C#N)C4=C(C=C(C=C4)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NN1NC(=O)C2=C(C(=C(S2)N3CCOCC3)C#N)C4=C(C=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C21H19Cl2N5O2S/c1-12-9-13(2)28(25-12)26-20(29)19-18(15-4-3-14(22)10-17(15)23)16(11-24)21(31-19)27-5-7-30-8-6-27/h3-4,9-10H,5-8H2,1-2H3,(H,26,29)