2-[(4-oxidanylidene-6-phenyl-5-propyl-1,3-diazinan-2-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(4-oxidanylidene-6-phenyl-5-propyl-1,3-diazinan-2-yl)sulfanyl]ethanamide Openeye Name: 2-(4-oxo-6-phenyl-5-propyl-hexahydropyrimidin-2-yl)sulfanylacetamide CAS Name: 2-[(4-oxo-6-phenyl-5-propyl-1,3-diazinan-2-yl)thio]acetamide IUPAC Name: 2-[(4-oxo-6-phenyl-5-propyl-1,3-diazinan-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-6-phenyl-5-propyl-hexahydropyrimidin-2-yl)thio]acetamide Formula: C30H42N6O4S2 MolecularWeight: 614.82228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2.CCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2

Isomeric SMILES

CCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2.CCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2

InChI

InChI=1S/2C15H21N3O2S/c2*1-2-6-11-13(10-7-4-3-5-8-10)17-15(18-14(11)20)21-9-12(16)19/h2*3-5,7-8,11,13,15,17H,2,6,9H2,1H3,(H2,16,19)(H,18,20)