5-[2-[(4-chlorophenyl)amino]pyrimidin-4-yl]-4-methyl-3-(3-methylbutyl)-1,3-thiazol-2-one

Systemtic Name: 5-[2-[(4-chlorophenyl)amino]pyrimidin-4-yl]-4-methyl-3-(3-methylbutyl)-1,3-thiazol-2-one Openeye Name: 5-[2-(4-chloroanilino)pyrimidin-4-yl]-3-isopentyl-4-methyl-thiazol-2-one CAS Name: 5-[2-(4-chloroanilino)-4-pyrimidinyl]-4-methyl-3-(3-methylbutyl)-2-thiazolone IUPAC Name: 5-[2-(4-chloroanilino)pyrimidin-4-yl]-4-methyl-3-(3-methylbutyl)-1,3-thiazol-2-one Traditional Name: 5-[2-(4-chloroanilino)pyrimidin-4-yl]-3-isoamyl-4-methyl-4-thiazolin-2-one Formula: C19H21ClN4OS MolecularWeight: 388.91424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1CCC(C)C)C2=NC(=NC=C2)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(SC(=O)N1CCC(C)C)C2=NC(=NC=C2)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21ClN4OS/c1-12(2)9-11-24-13(3)17(26-19(24)25)16-8-10-21-18(23-16)22-15-6-4-14(20)5-7-15/h4-8,10,12H,9,11H2,1-3H3,(H,21,22,23)