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

Systemtic Name: N6-(6-methoxy-1,3-benzothiazol-2-yl)-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-benzyl-N6-(6-methoxy-1,3-benzothiazol-2-yl)-N4-methyl-pyrimidine-4,5,6-triamine CAS Name: N6-(6-methoxy-1,3-benzothiazol-2-yl)-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-benzyl-6-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-N-methylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(6-methoxy-1,3-benzothiazol-2-yl)amino]pyrimidin-4-yl]-benzyl-methyl-amine Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)NC3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)NC3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C20H20N6OS/c1-26(11-13-6-4-3-5-7-13)19-17(21)18(22-12-23-19)25-20-24-15-9-8-14(27-2)10-16(15)28-20/h3-10,12H,11,21H2,1-2H3,(H,22,23,24,25)