2-methyl-6-[[[3-[[(phenylmethyl)amino]methyl]phenyl]methylamino]methyl]-2H-1,4-benzoxazin-3-amine

Systemtic Name: 2-methyl-6-[[[3-[[(phenylmethyl)amino]methyl]phenyl]methylamino]methyl]-2H-1,4-benzoxazin-3-amine Openeye Name: 6-[[[3-[(benzylamino)methyl]phenyl]methylamino]methyl]-2-methyl-2H-1,4-benzoxazin-3-amine CAS Name: 2-methyl-6-[[[3-[[(phenylmethyl)amino]methyl]phenyl]methylamino]methyl]-2H-1,4-benzoxazin-3-amine IUPAC Name: 6-[[[3-[(benzylamino)methyl]phenyl]methylamino]methyl]-2-methyl-2H-1,4-benzoxazin-3-amine Traditional Name: (3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methyl-[3-[(benzylamino)methyl]benzyl]amine Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NC2=C(O1)C=CC(=C2)CNCC3=CC=CC(=C3)CNCC4=CC=CC=C4)N

Isomeric SMILES

CC1C(=NC2=C(O1)C=CC(=C2)CNCC3=CC=CC(=C3)CNCC4=CC=CC=C4)N

InChI

InChI=1S/C25H28N4O/c1-18-25(26)29-23-13-22(10-11-24(23)30-18)17-28-16-21-9-5-8-20(12-21)15-27-14-19-6-3-2-4-7-19/h2-13,18,27-28H,14-17H2,1H3,(H2,26,29)