methyl 5-cyano-4-(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-naphthalen-2-yl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: methyl 5-cyano-4-(6-methoxy-1-oxidanylidene-3,4-dihydro-2H-naphthalen-2-yl)-6-oxidanylidene-2-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: methyl 5-cyano-4-(6-methoxy-1-oxo-tetralin-2-yl)-6-oxo-2-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: 5-cyano-4-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-6-oxo-2-sulfanylidene-1,3-diazinane-4-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-6-oxo-2-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: 5-cyano-6-keto-4-(1-keto-6-methoxy-tetralin-2-yl)-2-thioxo-hexahydropyrimidine-4-carboxylic acid methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(CC2)C3(C(C(=O)NC(=S)N3)C#N)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(CC2)C3(C(C(=O)NC(=S)N3)C#N)C(=O)OC

InChI

InChI=1S/C18H17N3O5S/c1-25-10-4-5-11-9(7-10)3-6-12(14(11)22)18(16(24)26-2)13(8-19)15(23)20-17(27)21-18/h4-5,7,12-13H,3,6H2,1-2H3,(H2,20,21,23,27)