2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(2-methylphenyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(2-methylphenyl)pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(o-tolyl)pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(2-methylphenyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(2-methylphenyl)pyrimidine-5-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-4-methyl-N-(o-tolyl)pyrimidine-5-carboxamide Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CN=C(N=C2C)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CN=C(N=C2C)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N5OS/c1-12-7-3-4-8-15(12)23-18(26)14-11-21-19(22-13(14)2)25-20-24-16-9-5-6-10-17(16)27-20/h3-11H,1-2H3,(H,23,26)(H,21,22,24,25)