N-butyl-2-[4-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-butyl-2-[4-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-butyl-2-[4-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-1-yl]-4-methyl-thiazole-5-carboxamide CAS Name: N-butyl-2-[4-[(2-chlorophenyl)methyl]-3,5-dimethyl-1-pyrazolyl]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-butyl-2-[4-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-butyl-2-[4-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-1-yl]-4-methyl-thiazole-5-carboxamide Formula: C21H25ClN4OS MolecularWeight: 416.9674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N=C(S1)N2C(=C(C(=N2)C)CC3=CC=CC=C3Cl)C)C

Isomeric SMILES

CCCCNC(=O)C1=C(N=C(S1)N2C(=C(C(=N2)C)CC3=CC=CC=C3Cl)C)C

InChI

InChI=1S/C21H25ClN4OS/c1-5-6-11-23-20(27)19-14(3)24-21(28-19)26-15(4)17(13(2)25-26)12-16-9-7-8-10-18(16)22/h7-10H,5-6,11-12H2,1-4H3,(H,23,27)