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

Systemtic Name: 2-[[6-(2-acetamidoethylamino)pyrimidin-4-yl]amino]-N-(2-chloranyl-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[[6-(2-acetamidoethylamino)pyrimidin-4-yl]amino]-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[6-(2-acetamidoethylamino)-4-pyrimidinyl]amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[[6-(2-acetamidoethylamino)pyrimidin-4-yl]amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[[6-(2-acetamidoethylamino)pyrimidin-4-yl]amino]-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C23H22ClN7O2S MolecularWeight: 495.98448

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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=CC(=NC=N4)NCCNC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC4=CC(=NC=N4)NCCNC(=O)C

InChI

InChI=1S/C23H22ClN7O2S/c1-13-4-3-5-16(24)21(13)31-22(33)15-6-7-17-18(10-15)34-23(29-17)30-20-11-19(27-12-28-20)26-9-8-25-14(2)32/h3-7,10-12H,8-9H2,1-2H3,(H,25,32)(H,31,33)(H2,26,27,28,29,30)