N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(5-methyl-2-thienyl)-1H-pyrazole-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(5-methyl-2-thiophenyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide Traditional Name: N-homopiperonyl-5-(5-methyl-2-thienyl)-1H-pyrazole-3-carboxamide Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CC(=NN2)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(S1)C2=CC(=NN2)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H17N3O3S/c1-11-2-5-17(25-11)13-9-14(21-20-13)18(22)19-7-6-12-3-4-15-16(8-12)24-10-23-15/h2-5,8-9H,6-7,10H2,1H3,(H,19,22)(H,20,21)