N4-(1,3-benzothiazol-2-yl)-6-(3,5-dimethylphenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzothiazol-2-yl)-6-(3,5-dimethylphenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzothiazol-2-yl)-6-(3,5-dimethylphenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzothiazol-2-yl)-6-(3,5-dimethylphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzothiazol-2-yl)-6-(3,5-dimethylphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-(1,3-benzothiazol-2-yl)amine Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H17N5OS/c1-11-7-12(2)9-13(8-11)25-18-16(20)17(21-10-22-18)24-19-23-14-5-3-4-6-15(14)26-19/h3-10H,20H2,1-2H3,(H,21,22,23,24)