5-(3-phenylpropylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(3-phenylpropylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(3-phenylpropylidene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(3-phenylpropylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(3-phenylpropylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-phenylpropylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC=C2C(=O)NC(=S)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CCC=C2C(=O)NC(=S)NC2=O

InChI

InChI=1S/C13H12N2O2S/c16-11-10(12(17)15-13(18)14-11)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2,(H2,14,15,16,17,18)