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

Systemtic Name: 2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-N-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: N-benzyl-2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazole-5-carboxamide CAS Name: 2-(4-butyl-3,5-dimethyl-1-pyrazolyl)-4-methyl-N-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: N-benzyl-2-(4-butyl-3,5-dimethylpyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-benzyl-2-(4-butyl-3,5-dimethyl-pyrazol-1-yl)-4-methyl-thiazole-5-carboxamide Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N=C1C)C2=NC(=C(S2)C(=O)NCC3=CC=CC=C3)C)C

Isomeric SMILES

CCCCC1=C(N(N=C1C)C2=NC(=C(S2)C(=O)NCC3=CC=CC=C3)C)C

InChI

InChI=1S/C21H26N4OS/c1-5-6-12-18-14(2)24-25(16(18)4)21-23-15(3)19(27-21)20(26)22-13-17-10-8-7-9-11-17/h7-11H,5-6,12-13H2,1-4H3,(H,22,26)