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

Systemtic Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-N6-(2-oxolanylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(6-methoxy-1,3-benzothiazol-2-yl)-6-N-(oxolan-2-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(6-methoxy-1,3-benzothiazol-2-yl)amino]pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C17H20N6O2S MolecularWeight: 372.4447

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NCC4CCCO4)N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)NCC4CCCO4)N

InChI

InChI=1S/C17H20N6O2S/c1-24-10-4-5-12-13(7-10)26-17(22-12)23-16-14(18)15(20-9-21-16)19-8-11-3-2-6-25-11/h4-5,7,9,11H,2-3,6,8,18H2,1H3,(H2,19,20,21,22,23)