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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-4-chloranyl-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-thienyl]-4-chloro-2-methyl-pyrazole-3-carboxamide CAS Name: N-[3-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-thiophenyl]-4-chloro-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylcarbamoyl)thiophen-2-yl]-4-chloro-2-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-2-methyl-N-[3-(piperonylcarbamoyl)-2-thienyl]pyrazole-3-carboxamide Formula: C18H15ClN4O4S MolecularWeight: 418.8541

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Cl)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=C(C=N1)Cl)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15ClN4O4S/c1-23-15(12(19)8-21-23)17(25)22-18-11(4-5-28-18)16(24)20-7-10-2-3-13-14(6-10)27-9-26-13/h2-6,8H,7,9H2,1H3,(H,20,24)(H,22,25)