2-(dibutylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile

Systemtic Name: 2-(dibutylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Openeye Name: 2-(dibutylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile CAS Name: 2-(dibutylamino)-3-(4-fluorophenyl)-7-(methylthio)-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile IUPAC Name: 2-(dibutylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Traditional Name: 2-(dibutylamino)-3-(4-fluorophenyl)-7-(methylthio)-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Formula: C23H28FN5S MolecularWeight: 425.565323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=NC2=C(C(=NC=C2CN1C3=CC=C(C=C3)F)SC)C#N

Isomeric SMILES

CCCCN(CCCC)C1=NC2=C(C(=NC=C2CN1C3=CC=C(C=C3)F)SC)C#N

InChI

InChI=1S/C23H28FN5S/c1-4-6-12-28(13-7-5-2)23-27-21-17(15-26-22(30-3)20(21)14-25)16-29(23)19-10-8-18(24)9-11-19/h8-11,15H,4-7,12-13,16H2,1-3H3