5,6-dimethyl-3-[(E)-(4-octoxyphenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-[(E)-(4-octoxyphenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-[(E)-(4-octoxyphenyl)methyleneamino]thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-[(E)-(4-octoxyphenyl)methylideneamino]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-[(E)-(4-octoxyphenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-[(E)-(4-octoxybenzylidene)amino]thieno[2,3-d]pyrimidin-4-one Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=NN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)/C=N/N2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C23H29N3O2S/c1-4-5-6-7-8-9-14-28-20-12-10-19(11-13-20)15-25-26-16-24-22-21(23(26)27)17(2)18(3)29-22/h10-13,15-16H,4-9,14H2,1-3H3/b25-15+