1-butyl-3-[(E)-[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]sulfanyl-urea

Systemtic Name: 1-butyl-3-[(E)-[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]sulfanyl-urea Openeye Name: 1-butyl-3-[(E)-(6-methyl-2,4-dioxo-pyran-3-ylidene)methyl]sulfanyl-urea CAS Name: 1-butyl-3-[[(E)-(6-methyl-2,4-dioxo-3-pyranylidene)methyl]thio]urea IUPAC Name: 1-butyl-3-[(E)-(6-methyl-2,4-dioxopyran-3-ylidene)methyl]sulfanylurea Traditional Name: 1-butyl-3-[[(E)-(2,4-diketo-6-methyl-pyran-3-ylidene)methyl]thio]urea Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NSC=C1C(=O)C=C(OC1=O)C

Isomeric SMILES

CCCCNC(=O)NS/C=C/1\C(=O)C=C(OC1=O)C

InChI

InChI=1S/C12H16N2O4S/c1-3-4-5-13-12(17)14-19-7-9-10(15)6-8(2)18-11(9)16/h6-7H,3-5H2,1-2H3,(H2,13,14,17)/b9-7+