3-[(E)-(4-butoxyphenyl)methylideneamino]-2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(E)-(4-butoxyphenyl)methylideneamino]-2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-[(E)-(4-butoxyphenyl)methyleneamino]-2-ethyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-[(E)-(4-butoxyphenyl)methylideneamino]-2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-[(E)-(4-butoxyphenyl)methylideneamino]-2-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-[(E)-(4-butoxybenzylidene)amino]-2-ethyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NN2C(=NC3=C(C2=O)C4=C(S3)CCCC4)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/N2C(=NC3=C(C2=O)C4=C(S3)CCCC4)CC

InChI

InChI=1S/C23H27N3O2S/c1-3-5-14-28-17-12-10-16(11-13-17)15-24-26-20(4-2)25-22-21(23(26)27)18-8-6-7-9-19(18)29-22/h10-13,15H,3-9,14H2,1-2H3/b24-15+