N-(2-chloranyl-6-methyl-phenyl)-2-[[6-[2-(1-methylpyrrolidin-2-yl)ethylamino]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[[6-[2-(1-methylpyrrolidin-2-yl)ethylamino]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[[6-[2-(1-methylpyrrolidin-2-yl)ethylamino]pyrimidin-4-yl]amino]thiazole-5-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[6-[2-(1-methyl-2-pyrrolidinyl)ethylamino]-4-pyrimidinyl]amino]-5-thiazolecarboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[[6-[2-(1-methylpyrrolidin-2-yl)ethylamino]pyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[[6-[2-(1-methylpyrrolidin-2-yl)ethylamino]pyrimidin-4-yl]amino]thiazole-5-carboxamide Formula: C22H26ClN7OS MolecularWeight: 472.00614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC=N3)NCCC4CCCN4C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC=N3)NCCC4CCCN4C

InChI

InChI=1S/C22H26ClN7OS/c1-14-5-3-7-16(23)20(14)29-21(31)17-12-25-22(32-17)28-19-11-18(26-13-27-19)24-9-8-15-6-4-10-30(15)2/h3,5,7,11-13,15H,4,6,8-10H2,1-2H3,(H,29,31)(H2,24,25,26,27,28)