1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-propyl-4-thiophen-2-yl-pyrrole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-propyl-4-thiophen-2-yl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-propyl-4-(2-thienyl)pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-propyl-4-thiophen-2-yl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-2-methyl-5-propyl-4-thiophen-2-ylpyrrole-3-carboxamide Traditional Name: 2-methyl-1-piperonyl-5-propyl-4-(2-thienyl)pyrrole-3-carboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC=CS4

Isomeric SMILES

CCCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC=CS4

InChI

InChI=1S/C21H22N2O3S/c1-3-5-15-20(18-6-4-9-27-18)19(21(22)24)13(2)23(15)11-14-7-8-16-17(10-14)26-12-25-16/h4,6-10H,3,5,11-12H2,1-2H3,(H2,22,24)