N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-methyl-propanamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]thiazol-2-yl]-2-methyl-propanamide CAS Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-2-thiazolyl]-2-methylpropanamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]-2-methylpropanamide Traditional Name: N-[4-[2-keto-2-(piperonylamino)ethyl]thiazol-2-yl]-2-methyl-propionamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC(=CS1)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)C(=O)NC1=NC(=CS1)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19N3O4S/c1-10(2)16(22)20-17-19-12(8-25-17)6-15(21)18-7-11-3-4-13-14(5-11)24-9-23-13/h3-5,8,10H,6-7,9H2,1-2H3,(H,18,21)(H,19,20,22)