6-chloranyl-N-[1-(phenylmethyl)indazol-5-yl]pyrido[3,4-d]pyrimidin-4-amine hydrochloride

Systemtic Name: 6-chloranyl-N-[1-(phenylmethyl)indazol-5-yl]pyrido[3,4-d]pyrimidin-4-amine hydrochloride Openeye Name: N-(1-benzylindazol-5-yl)-6-chloro-pyrido[3,4-d]pyrimidin-4-amine hydrochloride CAS Name: 6-chloro-N-[1-(phenylmethyl)-5-indazolyl]-4-pyrido[3,4-d]pyrimidinamine hydrochloride IUPAC Name: N-(1-benzylindazol-5-yl)-6-chloropyrido[3,4-d]pyrimidin-4-amine hydrochloride Traditional Name: (1-benzylindazol-5-yl)-(6-chloropyrido[3,4-d]pyrimidin-4-yl)amine hydrochloride Formula: C21H16Cl2N6 MolecularWeight: 423.29794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC5=CN=C(C=C54)Cl)C=N2.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC5=CN=C(C=C54)Cl)C=N2.Cl

InChI

InChI=1S/C21H15ClN6.ClH/c22-20-9-17-18(11-23-20)24-13-25-21(17)27-16-6-7-19-15(8-16)10-26-28(19)12-14-4-2-1-3-5-14;/h1-11,13H,12H2,(H,24,25,27);1H