tert-butyl N-[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-3-thiophen-2-yl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-3-thiophen-2-yl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-1-(2-thienylmethyl)ethyl]carbamate CAS Name: N-[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxo-3-thiophen-2-ylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxo-3-thiophen-2-ylpropan-2-yl]carbamate Traditional Name: N-[2-keto-2-(piperonylamino)-1-(2-thenyl)ethyl]carbamic acid tert-butyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CS1)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CS1)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H24N2O5S/c1-20(2,3)27-19(24)22-15(10-14-5-4-8-28-14)18(23)21-11-13-6-7-16-17(9-13)26-12-25-16/h4-9,15H,10-12H2,1-3H3,(H,21,23)(H,22,24)