N6-(1,3-benzothiazol-6-yl)-N4-[[2,4-bis(fluoranyl)phenyl]methyl]-N2-methyl-N2-[2-(methylamino)ethyl]-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N6-(1,3-benzothiazol-6-yl)-N4-[[2,4-bis(fluoranyl)phenyl]methyl]-N2-methyl-N2-[2-(methylamino)ethyl]-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(1,3-benzothiazol-6-yl)-N4-[(2,4-difluorophenyl)methyl]-N2-methyl-N2-[2-(methylamino)ethyl]-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(1,3-benzothiazol-6-yl)-N4-[(2,4-difluorophenyl)methyl]-N2-methyl-N2-[2-(methylamino)ethyl]-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(1,3-benzothiazol-6-yl)-4-N-[(2,4-difluorophenyl)methyl]-2-N-methyl-2-N-[2-(methylamino)ethyl]-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(1,3-benzothiazol-6-ylamino)-6-[(2,4-difluorobenzyl)amino]-s-triazin-2-yl]-methyl-[2-(methylamino)ethyl]amine Formula: C21H22F2N8S MolecularWeight: 456.514786

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Descriptors Computed from Structure

Canonical SMILES:

CNCCN(C)C1=NC(=NC(=N1)NCC2=C(C=C(C=C2)F)F)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CNCCN(C)C1=NC(=NC(=N1)NCC2=C(C=C(C=C2)F)F)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C21H22F2N8S/c1-24-7-8-31(2)21-29-19(25-11-13-3-4-14(22)9-16(13)23)28-20(30-21)27-15-5-6-17-18(10-15)32-12-26-17/h3-6,9-10,12,24H,7-8,11H2,1-2H3,(H2,25,27,28,29,30)