3-[(Z)-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylideneamino]-6-ethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(Z)-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylideneamino]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(Z)-(3-chloro-5-ethoxy-4-propoxy-phenyl)methyleneamino]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(Z)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(Z)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(Z)-(3-chloro-5-ethoxy-4-propoxy-benzylidene)amino]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=NN2C=NC3=C(C2=O)C=C(S3)CC)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=N\N2C=NC3=C(C2=O)C=C(S3)CC)OCC

InChI

InChI=1S/C20H22ClN3O3S/c1-4-7-27-18-16(21)8-13(9-17(18)26-6-3)11-23-24-12-22-19-15(20(24)25)10-14(5-2)28-19/h8-12H,4-7H2,1-3H3/b23-11-