2-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]-phenylazanyl-methyl]sulfanyl-N-propyl-ethanamide

Systemtic Name: 2-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]-phenylazanyl-methyl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[anilino-(1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methyl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[anilino-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]thio]-N-propylacetamide IUPAC Name: 2-[anilino-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]sulfanyl-N-propylacetamide Traditional Name: 2-[[anilino-(2,4,6-triketo-1,3-dimethyl-hexahydropyrimidin-5-ylidene)methyl]thio]-N-propyl-acetamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC(=C1C(=O)N(C(=O)N(C1=O)C)C)NC2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)CSC(=C1C(=O)N(C(=O)N(C1=O)C)C)NC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O4S/c1-4-10-19-13(23)11-27-15(20-12-8-6-5-7-9-12)14-16(24)21(2)18(26)22(3)17(14)25/h5-9,20H,4,10-11H2,1-3H3,(H,19,23)