N2-(1,3-benzothiazol-6-yl)-5-bromanyl-N4-(4-methoxyphenyl)pyrimidine-2,4-diamine

Systemtic Name: N2-(1,3-benzothiazol-6-yl)-5-bromanyl-N4-(4-methoxyphenyl)pyrimidine-2,4-diamine Openeye Name: N2-(1,3-benzothiazol-6-yl)-5-bromo-N4-(4-methoxyphenyl)pyrimidine-2,4-diamine CAS Name: N2-(1,3-benzothiazol-6-yl)-5-bromo-N4-(4-methoxyphenyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(1,3-benzothiazol-6-yl)-5-bromo-4-N-(4-methoxyphenyl)pyrimidine-2,4-diamine Traditional Name: 1,3-benzothiazol-6-yl-[5-bromo-4-(p-anisidino)pyrimidin-2-yl]amine Formula: C18H14BrN5OS MolecularWeight: 428.30566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC=C2Br)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C18H14BrN5OS/c1-25-13-5-2-11(3-6-13)22-17-14(19)9-20-18(24-17)23-12-4-7-15-16(8-12)26-10-21-15/h2-10H,1H3,(H2,20,22,23,24)