N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-butyl-5-chloranyl-3-methyl-pyrazole-4-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-butyl-5-chloro-3-methyl-pyrazole-4-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-1-butyl-5-chloro-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-butyl-5-chloro-3-methylpyrazole-4-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-butyl-5-chloro-3-methyl-pyrazole-4-carboxamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C19H19ClN4O3S/c1-3-4-7-24-17(20)16(11(2)23-24)18(25)22-19-21-13(9-28-19)12-5-6-14-15(8-12)27-10-26-14/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,21,22,25)