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

Systemtic Name: 5-methoxy-5-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-benzyl-5-methoxy-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-methoxy-5-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-benzyl-5-methoxy-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-benzyl-5-methoxy-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(=O)NC(=S)NC1=O)CC2=CC=CC=C2

Isomeric SMILES

COC1(C(=O)NC(=S)NC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3S/c1-17-12(7-8-5-3-2-4-6-8)9(15)13-11(18)14-10(12)16/h2-6H,7H2,1H3,(H2,13,14,15,16,18)