N-[(E)-(2-chloranyl-7-methoxy-quinolin-3-yl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(E)-(2-chloranyl-7-methoxy-quinolin-3-yl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(E)-(2-chloro-7-methoxy-3-quinolyl)methyleneamino]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(E)-(2-chloro-7-methoxy-3-quinolinyl)methylideneamino]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(E)-(2-chloro-7-methoxyquinolin-3-yl)methylideneamino]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(E)-(2-chloro-7-methoxy-3-quinolyl)methyleneamino]-2-(2-pyrimidylthio)acetamide Formula: C17H14ClN5O2S MolecularWeight: 387.84336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C=NNC(=O)CSC3=NC=CC=N3)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)/C=N/NC(=O)CSC3=NC=CC=N3)Cl

InChI

InChI=1S/C17H14ClN5O2S/c1-25-13-4-3-11-7-12(16(18)22-14(11)8-13)9-21-23-15(24)10-26-17-19-5-2-6-20-17/h2-9H,10H2,1H3,(H,23,24)/b21-9+