5-(3-bromophenyl)-6-pentyl-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(3-bromophenyl)-6-pentyl-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3-bromophenyl)-6-pentyl-7-(2-thienyl)pyrido[2,3-d]pyrimidin-4-amine CAS Name: 5-(3-bromophenyl)-6-pentyl-7-thiophen-2-yl-4-pyrido[2,3-d]pyrimidinamine IUPAC Name: 5-(3-bromophenyl)-6-pentyl-7-thiophen-2-ylpyrido[2,3-d]pyrimidin-4-amine Traditional Name: [6-amyl-5-(3-bromophenyl)-7-(2-thienyl)pyrido[2,3-d]pyrimidin-4-yl]amine Formula: C22H21BrN4S MolecularWeight: 453.39794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N=C2C(=C1C3=CC(=CC=C3)Br)C(=NC=N2)N)C4=CC=CS4

Isomeric SMILES

CCCCCC1=C(N=C2C(=C1C3=CC(=CC=C3)Br)C(=NC=N2)N)C4=CC=CS4

InChI

InChI=1S/C22H21BrN4S/c1-2-3-4-9-16-18(14-7-5-8-15(23)12-14)19-21(24)25-13-26-22(19)27-20(16)17-10-6-11-28-17/h5-8,10-13H,2-4,9H2,1H3,(H2,24,25,26,27)