N4-(6-methoxy-1,3-benzothiazol-2-yl)-6-naphthalen-2-yloxy-pyrimidine-4,5-diamine

Systemtic Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-6-naphthalen-2-yloxy-pyrimidine-4,5-diamine Openeye Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-6-(2-naphthyloxy)pyrimidine-4,5-diamine CAS Name: N4-(6-methoxy-1,3-benzothiazol-2-yl)-6-(2-naphthalenyloxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(6-methoxy-1,3-benzothiazol-2-yl)-6-naphthalen-2-yloxypyrimidine-4,5-diamine Traditional Name: [5-amino-6-(2-naphthoxy)pyrimidin-4-yl]-(6-methoxy-1,3-benzothiazol-2-yl)amine Formula: C22H17N5O2S MolecularWeight: 415.46768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)N

InChI

InChI=1S/C22H17N5O2S/c1-28-15-8-9-17-18(11-15)30-22(26-17)27-20-19(23)21(25-12-24-20)29-16-7-6-13-4-2-3-5-14(13)10-16/h2-12H,23H2,1H3,(H,24,25,26,27)