N-[(E)-(2-chloranyl-7-methoxy-quinolin-3-yl)methylideneamino]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(E)-(2-chloranyl-7-methoxy-quinolin-3-yl)methylideneamino]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(E)-(2-chloro-7-methoxy-3-quinolyl)methyleneamino]-5-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(E)-(2-chloro-7-methoxy-3-quinolinyl)methylideneamino]-5-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(E)-(2-chloro-7-methoxyquinolin-3-yl)methylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [(E)-(2-chloro-7-methoxy-3-quinolyl)methyleneamino]-(5-phenylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C23H16ClN5OS MolecularWeight: 445.92404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C=NNC3=C4C(=CSC4=NC=N3)C5=CC=CC=C5)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)/C=N/NC3=C4C(=CSC4=NC=N3)C5=CC=CC=C5)Cl

InChI

InChI=1S/C23H16ClN5OS/c1-30-17-8-7-15-9-16(21(24)28-19(15)10-17)11-27-29-22-20-18(14-5-3-2-4-6-14)12-31-23(20)26-13-25-22/h2-13H,1H3,(H,25,26,29)/b27-11+