1-octyl-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione

Systemtic Name: 1-octyl-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione Openeye Name: 1-octyl-5-(3-thienylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-octyl-2-sulfanylidene-5-(3-thiophenylmethylidene)-1,3-diazinane-4,6-dione IUPAC Name: 1-octyl-2-sulfanylidene-5-(thiophen-3-ylmethylidene)-1,3-diazinane-4,6-dione Traditional Name: 1-octyl-5-(3-thenylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H22N2O2S2 MolecularWeight: 350.49878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(=CC2=CSC=C2)C(=O)NC1=S

Isomeric SMILES

CCCCCCCCN1C(=O)C(=CC2=CSC=C2)C(=O)NC1=S

InChI

InChI=1S/C17H22N2O2S2/c1-2-3-4-5-6-7-9-19-16(21)14(15(20)18-17(19)22)11-13-8-10-23-12-13/h8,10-12H,2-7,9H2,1H3,(H,18,20,22)