N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-4,6-dimethyl-pyrimidin-2-amine

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-4,6-dimethyl-pyrimidin-2-amine Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-4,6-dimethyl-pyrimidin-2-amine CAS Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-4,6-dimethyl-2-pyrimidinamine IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-4,6-dimethylpyrimidin-2-amine Traditional Name: [4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-(4,6-dimethylpyrimidin-2-yl)amine Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)OC)C

InChI

InChI=1S/C20H18N4OS/c1-12-10-13(2)22-20(21-12)23-14-8-9-15(17(11-14)25-3)19-24-16-6-4-5-7-18(16)26-19/h4-11H,1-3H3,(H,21,22,23)