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

Systemtic Name: 2-(dipentylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Openeye Name: 2-(dipentylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile CAS Name: 2-(dipentylamino)-3-(4-fluorophenyl)-7-(methylthio)-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile IUPAC Name: 2-(dipentylamino)-3-(4-fluorophenyl)-7-methylsulfanyl-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Traditional Name: 2-(diamylamino)-3-(4-fluorophenyl)-7-(methylthio)-4H-pyrido[4,3-d]pyrimidine-8-carbonitrile Formula: C25H32FN5S MolecularWeight: 453.618483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C1=NC2=C(C(=NC=C2CN1C3=CC=C(C=C3)F)SC)C#N

Isomeric SMILES

CCCCCN(CCCCC)C1=NC2=C(C(=NC=C2CN1C3=CC=C(C=C3)F)SC)C#N

InChI

InChI=1S/C25H32FN5S/c1-4-6-8-14-30(15-9-7-5-2)25-29-23-19(17-28-24(32-3)22(23)16-27)18-31(25)21-12-10-20(26)11-13-21/h10-13,17H,4-9,14-15,18H2,1-3H3