5-ethyl-1-heptan-3-yl-3,6-dimethyl-4-oxidanylidene-2H-pyrimidine-2-carbothialdehyde

Systemtic Name: 5-ethyl-1-heptan-3-yl-3,6-dimethyl-4-oxidanylidene-2H-pyrimidine-2-carbothialdehyde Openeye Name: 5-ethyl-1-(1-ethylpentyl)-3,6-dimethyl-4-oxo-2H-pyrimidine-2-carbothialdehyde CAS Name: 5-ethyl-1-heptan-3-yl-3,6-dimethyl-4-oxo-2H-pyrimidine-2-carbothioaldehyde IUPAC Name: 5-ethyl-1-heptan-3-yl-3,6-dimethyl-4-oxo-2H-pyrimidine-2-carbothialdehyde Traditional Name: 5-ethyl-1-(1-ethylpentyl)-4-keto-3,6-dimethyl-2H-pyrimidine-2-carbothialdehyde Formula: C16H28N2OS MolecularWeight: 296.47132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)N1C(N(C(=O)C(=C1C)CC)C)C=S

Isomeric SMILES

CCCCC(CC)N1C(N(C(=O)C(=C1C)CC)C)C=S

InChI

InChI=1S/C16H28N2OS/c1-6-9-10-13(7-2)18-12(4)14(8-3)16(19)17(5)15(18)11-20/h11,13,15H,6-10H2,1-5H3