N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-2H-1,4-benzoxazin-3-amine

Systemtic Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-2H-1,4-benzoxazin-3-amine Openeye Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-2H-1,4-benzoxazin-3-amine CAS Name: N-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2H-1,4-benzoxazin-3-amine IUPAC Name: N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-2H-1,4-benzoxazin-3-amine Traditional Name: 2H-1,4-benzoxazin-3-yl-[4-[4-(2-pyrimidyl)piperazino]butyl]amine Formula: C20H26N6O MolecularWeight: 366.46004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC2=NC3=CC=CC=C3OC2)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCNC2=NC3=CC=CC=C3OC2)C4=NC=CC=N4

InChI

InChI=1S/C20H26N6O/c1-2-7-18-17(6-1)24-19(16-27-18)21-8-3-4-11-25-12-14-26(15-13-25)20-22-9-5-10-23-20/h1-2,5-7,9-10H,3-4,8,11-16H2,(H,21,24)