ethyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-(2-morpholin-4-ylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-(2-morpholin-4-ylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(2-morpholinoacetyl)amino]thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[2-(4-morpholinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(2-morpholin-4-ylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(2-morpholinoacetyl)amino]-5-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)CN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)CN4CCOCC4

InChI

InChI=1S/C22H26N2O6S/c1-3-28-22(26)20-14(2)18(11-15-4-5-16-17(10-15)30-13-29-16)31-21(20)23-19(25)12-24-6-8-27-9-7-24/h4-5,10H,3,6-9,11-13H2,1-2H3,(H,23,25)