(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-phenyl-3-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-phenyl-3-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-(1,3-benzodioxol-5-ylmethylene)-1-phenyl-3-propyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-phenyl-3-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-phenyl-3-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-phenyl-5-piperonylidene-3-propyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)C(=O)N(C1=S)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)N(C1=S)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S/c1-2-10-22-19(24)16(11-14-8-9-17-18(12-14)27-13-26-17)20(25)23(21(22)28)15-6-4-3-5-7-15/h3-9,11-12H,2,10,13H2,1H3/b16-11+