2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 2-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]pyrimidine-5-carbonitrile CAS Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-5-pyrimidinecarbonitrile IUPAC Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]pyrimidine-5-carbonitrile Traditional Name: 2-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]pyrimidine-5-carbonitrile Formula: C19H13N5S MolecularWeight: 343.40502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NC=C(C=N4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=NC=C(C=N4)C#N

InChI

InChI=1S/C19H13N5S/c1-12-2-7-16-17(8-12)25-18(24-16)14-3-5-15(6-4-14)23-19-21-10-13(9-20)11-22-19/h2-8,10-11H,1H3,(H,21,22,23)