6-chloranyl-N-[2-(phenylmethyl)-3H-benzimidazol-5-yl]pyrido[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[2-(phenylmethyl)-3H-benzimidazol-5-yl]pyrido[3,4-d]pyrimidin-4-amine Openeye Name: N-(2-benzyl-3H-benzimidazol-5-yl)-6-chloro-pyrido[3,4-d]pyrimidin-4-amine CAS Name: 6-chloro-N-[2-(phenylmethyl)-3H-benzimidazol-5-yl]-4-pyrido[3,4-d]pyrimidinamine IUPAC Name: N-(2-benzyl-3H-benzimidazol-5-yl)-6-chloropyrido[3,4-d]pyrimidin-4-amine Traditional Name: (2-benzyl-3H-benzimidazol-5-yl)-(6-chloropyrido[3,4-d]pyrimidin-4-yl)amine Formula: C21H15ClN6 MolecularWeight: 386.837

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)NC4=NC=NC5=CN=C(C=C54)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)NC4=NC=NC5=CN=C(C=C54)Cl

InChI

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