N-(2-chloranyl-6-methyl-phenyl)-2-[(6-methylpyrimidin-4-yl)amino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[(6-methylpyrimidin-4-yl)amino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[(6-methylpyrimidin-4-yl)amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[(6-methyl-4-pyrimidinyl)amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[(6-methylpyrimidin-4-yl)amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[(6-methylpyrimidin-4-yl)amino]-1,3-benzothiazole-6-carboxamide Formula: C20H16ClN5OS MolecularWeight: 409.89194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC4=NC=NC(=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC4=NC=NC(=C4)C

InChI

InChI=1S/C20H16ClN5OS/c1-11-4-3-5-14(21)18(11)26-19(27)13-6-7-15-16(9-13)28-20(24-15)25-17-8-12(2)22-10-23-17/h3-10H,1-2H3,(H,26,27)(H,22,23,24,25)