N-[1-[2-[(8-methoxyquinolin-5-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]thiophene-3-carboxamide

Systemtic Name: N-[1-[2-[(8-methoxyquinolin-5-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]thiophene-3-carboxamide Openeye Name: N-[1-[2-[(8-methoxy-5-quinolyl)methyl-methyl-amino]-2-oxo-ethyl]pyrazol-4-yl]thiophene-3-carboxamide CAS Name: N-[1-[2-[(8-methoxy-5-quinolinyl)methyl-methylamino]-2-oxoethyl]-4-pyrazolyl]-3-thiophenecarboxamide IUPAC Name: N-[1-[2-[(8-methoxyquinolin-5-yl)methyl-methylamino]-2-oxoethyl]pyrazol-4-yl]thiophene-3-carboxamide Traditional Name: N-[1-[2-keto-2-[(8-methoxy-5-quinolyl)methyl-methyl-amino]ethyl]pyrazol-4-yl]thiophene-3-carboxamide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C2C=CC=NC2=C(C=C1)OC)C(=O)CN3C=C(C=N3)NC(=O)C4=CSC=C4

Isomeric SMILES

CN(CC1=C2C=CC=NC2=C(C=C1)OC)C(=O)CN3C=C(C=N3)NC(=O)C4=CSC=C4

InChI

InChI=1S/C22H21N5O3S/c1-26(11-15-5-6-19(30-2)21-18(15)4-3-8-23-21)20(28)13-27-12-17(10-24-27)25-22(29)16-7-9-31-14-16/h3-10,12,14H,11,13H2,1-2H3,(H,25,29)