N4-methyl-N6-(4-methyl-1,3-benzothiazol-2-yl)-N4-(phenylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-methyl-N6-(4-methyl-1,3-benzothiazol-2-yl)-N4-(phenylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-benzyl-N4-methyl-N6-(4-methyl-1,3-benzothiazol-2-yl)pyrimidine-4,5,6-triamine CAS Name: N4-methyl-N6-(4-methyl-1,3-benzothiazol-2-yl)-N4-(phenylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-benzyl-4-N-methyl-6-N-(4-methyl-1,3-benzothiazol-2-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-methyl-1,3-benzothiazol-2-yl)amino]pyrimidin-4-yl]-benzyl-methyl-amine Formula: C20H20N6S MolecularWeight: 376.478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)N(C)CC4=CC=CC=C4)N

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)N(C)CC4=CC=CC=C4)N

InChI

InChI=1S/C20H20N6S/c1-13-7-6-10-15-17(13)24-20(27-15)25-18-16(21)19(23-12-22-18)26(2)11-14-8-4-3-5-9-14/h3-10,12H,11,21H2,1-2H3,(H,22,23,24,25)