4,6,7-trimethyl-N-[3-(phenylmethyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl]quinazolin-2-amine

Systemtic Name: 4,6,7-trimethyl-N-[3-(phenylmethyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl]quinazolin-2-amine Openeye Name: N-(3-benzyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,6,7-trimethyl-quinazolin-2-amine CAS Name: 4,6,7-trimethyl-N-[3-(phenylmethyl)-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl]-2-quinazolinamine IUPAC Name: N-(3-benzyl-1,2,3,4-tetrahydro-1,3,5-triazin-3-ium-6-yl)-4,6,7-trimethylquinazolin-2-amine Traditional Name: (3-benzyl-1,2,3,4-tetrahydro-s-triazin-3-ium-6-yl)-(4,6,7-trimethylquinazolin-2-yl)amine Formula: C21H25N6+ MolecularWeight: 361.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC[NH+](CN3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC[NH+](CN3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C21H24N6/c1-14-9-18-16(3)24-21(25-19(18)10-15(14)2)26-20-22-12-27(13-23-20)11-17-7-5-4-6-8-17/h4-10H,11-13H2,1-3H3,(H2,22,23,24,25,26)/p+1