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

Systemtic Name: 2-[(4-azanylpyridin-2-yl)amino]-N-(2-chloranyl-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(4-amino-2-pyridyl)amino]-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[(4-amino-2-pyridinyl)amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(4-aminopyridin-2-yl)amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(4-amino-2-pyridyl)amino]-N-(2-chloro-6-methyl-phenyl)-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=CC(=C4)N

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN5OS/c1-11-3-2-4-14(21)18(11)26-19(27)12-5-6-15-16(9-12)28-20(24-15)25-17-10-13(22)7-8-23-17/h2-10H,1H3,(H,26,27)(H3,22,23,24,25)