(5S)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-ethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-1-ethyl-5-(piperonyliminomethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H15N3O4S MolecularWeight: 333.3623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(C(=O)NC1=S)C=NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1C(=O)[C@H](C(=O)NC1=S)C=NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H15N3O4S/c1-2-18-14(20)10(13(19)17-15(18)23)7-16-6-9-3-4-11-12(5-9)22-8-21-11/h3-5,7,10H,2,6,8H2,1H3,(H,17,19,23)/t10-/m0/s1