3-[(4-hexoxy-3-methoxy-phenyl)methylideneamino]-2-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-hexoxy-3-methoxy-phenyl)methylideneamino]-2-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-hexoxy-3-methoxy-phenyl)methyleneamino]-2-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-hexoxy-3-methoxyphenyl)methylideneamino]-2-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-hexoxy-3-methoxyphenyl)methylideneamino]-2-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(4-hexoxy-3-methoxy-benzylidene)amino]-2-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=NN2C(=NC3=C(C2=O)C=CS3)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C=NN2C(=NC3=C(C2=O)C=CS3)C)OC

InChI

InChI=1S/C21H25N3O3S/c1-4-5-6-7-11-27-18-9-8-16(13-19(18)26-3)14-22-24-15(2)23-20-17(21(24)25)10-12-28-20/h8-10,12-14H,4-7,11H2,1-3H3