2-[4-[(3-bromophenyl)amino]pyrido[3,4-d]pyrimidin-6-yl]sulfanylethanol

Systemtic Name: 2-[4-[(3-bromophenyl)amino]pyrido[3,4-d]pyrimidin-6-yl]sulfanylethanol Openeye Name: 2-[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]sulfanylethanol CAS Name: 2-[[4-(3-bromoanilino)-6-pyrido[3,4-d]pyrimidinyl]thio]ethanol IUPAC Name: 2-[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]sulfanylethanol Traditional Name: 2-[[4-(3-bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]thio]ethanol Formula: C15H13BrN4OS MolecularWeight: 377.25892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CN=C(C=C32)SCCO

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CN=C(C=C32)SCCO

InChI

InChI=1S/C15H13BrN4OS/c16-10-2-1-3-11(6-10)20-15-12-7-14(22-5-4-21)17-8-13(12)18-9-19-15/h1-3,6-9,21H,4-5H2,(H,18,19,20)