6-(1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 6-(1,3-benzodioxol-5-yl)-3-phenyl-2-thioxo-hexahydropyrimidin-4-one CAS Name: 6-(1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 6-(1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 6-(1,3-benzodioxol-5-yl)-3-phenyl-2-thioxo-hexahydropyrimidin-4-one Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=S)N(C1=O)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C(NC(=S)N(C1=O)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H14N2O3S/c20-16-9-13(11-6-7-14-15(8-11)22-10-21-14)18-17(23)19(16)12-4-2-1-3-5-12/h1-8,13H,9-10H2,(H,18,23)