ethyl 2-[4-azanyl-5-(3-bromophenyl)-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-6-yl]ethanoate

Systemtic Name: ethyl 2-[4-azanyl-5-(3-bromophenyl)-7-thiophen-2-yl-pyrido[2,3-d]pyrimidin-6-yl]ethanoate Openeye Name: ethyl 2-[4-amino-5-(3-bromophenyl)-7-(2-thienyl)pyrido[2,3-d]pyrimidin-6-yl]acetate CAS Name: 2-[4-amino-5-(3-bromophenyl)-7-thiophen-2-yl-6-pyrido[2,3-d]pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-amino-5-(3-bromophenyl)-7-thiophen-2-ylpyrido[2,3-d]pyrimidin-6-yl]acetate Traditional Name: 2-[4-amino-5-(3-bromophenyl)-7-(2-thienyl)pyrido[2,3-d]pyrimidin-6-yl]acetic acid ethyl ester Formula: C21H17BrN4O2S MolecularWeight: 469.35428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=C2C(=C1C3=CC(=CC=C3)Br)C(=NC=N2)N)C4=CC=CS4

Isomeric SMILES

CCOC(=O)CC1=C(N=C2C(=C1C3=CC(=CC=C3)Br)C(=NC=N2)N)C4=CC=CS4

InChI

InChI=1S/C21H17BrN4O2S/c1-2-28-16(27)10-14-17(12-5-3-6-13(22)9-12)18-20(23)24-11-25-21(18)26-19(14)15-7-4-8-29-15/h3-9,11H,2,10H2,1H3,(H2,23,24,25,26)