N-(3-chloranyl-2-methyl-phenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(4-isopentyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazole-5-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)-1-pyrazolyl]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[3,5-dimethyl-4-(3-methylbutyl)pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-(4-isoamyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazole-5-carboxamide Formula: C22H27ClN4OS MolecularWeight: 430.99398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(N=C(S2)N3C(=C(C(=N3)C)CCC(C)C)C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(N=C(S2)N3C(=C(C(=N3)C)CCC(C)C)C)C

InChI

InChI=1S/C22H27ClN4OS/c1-12(2)10-11-17-14(4)26-27(16(17)6)22-24-15(5)20(29-22)21(28)25-19-9-7-8-18(23)13(19)3/h7-9,12H,10-11H2,1-6H3,(H,25,28)