N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]-N-piperonyl-acetamide Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17N3O4S/c1-2-11-6-14(20)19-16(18-11)24-8-15(21)17-7-10-3-4-12-13(5-10)23-9-22-12/h3-6H,2,7-9H2,1H3,(H,17,21)(H,18,19,20)