1-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-oxidanylidene-2-propyl-N-[(1R)-1-thiophen-2-ylpropyl]pyridine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-oxidanylidene-2-propyl-N-[(1R)-1-thiophen-2-ylpropyl]pyridine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-oxo-2-propyl-N-[(1R)-1-(2-thienyl)propyl]pyridine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-oxo-2-propyl-N-[(1R)-1-thiophen-2-ylpropyl]-3-pyridinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-6-methyl-4-oxo-2-propyl-N-[(1R)-1-thiophen-2-ylpropyl]pyridine-3-carboxamide Traditional Name: 4-keto-6-methyl-1-piperonyl-2-propyl-N-[(1R)-1-(2-thienyl)propyl]nicotinamide Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC1=C(C(=O)C=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N[C@H](CC)C4=CC=CS4

InChI

InChI=1S/C25H28N2O4S/c1-4-7-19-24(25(29)26-18(5-2)23-8-6-11-32-23)20(28)12-16(3)27(19)14-17-9-10-21-22(13-17)31-15-30-21/h6,8-13,18H,4-5,7,14-15H2,1-3H3,(H,26,29)/t18-/m1/s1