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

Systemtic Name: N4-(4-methyl-1,3-benzothiazol-2-yl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-methyl-1,3-benzothiazol-2-yl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-methyl-1,3-benzothiazol-2-yl)-N6-(2-oxolanylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-methyl-1,3-benzothiazol-2-yl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-methyl-1,3-benzothiazol-2-yl)amino]pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NCC4CCCO4)N

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NCC4CCCO4)N

InChI

InChI=1S/C17H20N6OS/c1-10-4-2-6-12-14(10)22-17(25-12)23-16-13(18)15(20-9-21-16)19-8-11-5-3-7-24-11/h2,4,6,9,11H,3,5,7-8,18H2,1H3,(H2,19,20,21,22,23)