5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)pyrimidin-4-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-(3-pyridylmethyl)pyrimidin-4-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-(3-pyridinylmethyl)-4-pyrimidinamine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)pyrimidin-4-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CN=CN=C3NCC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CN=CN=C3NCC4=CN=CC=C4

InChI

InChI=1S/C17H14N4O2/c1-2-12(7-18-5-1)8-20-17-14(9-19-10-21-17)13-3-4-15-16(6-13)23-11-22-15/h1-7,9-10H,8,11H2,(H,19,20,21)