N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-[(4-oxidanylidene-1,3-diazinan-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-[(4-oxidanylidene-1,3-diazinan-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-morpholino-phenyl)-2-(4-oxohexahydropyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[3-chloro-4-(4-morpholinyl)phenyl]-2-[(4-oxo-1,3-diazinan-2-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-morpholin-4-ylphenyl)-2-[(4-oxo-1,3-diazinan-2-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-morpholino-phenyl)-2-[(4-ketohexahydropyrimidin-2-yl)thio]acetamide Formula: C16H21ClN4O3S MolecularWeight: 384.88094

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(NC1=O)SCC(=O)NC2=CC(=C(C=C2)N3CCOCC3)Cl

Isomeric SMILES

C1CNC(NC1=O)SCC(=O)NC2=CC(=C(C=C2)N3CCOCC3)Cl

InChI

InChI=1S/C16H21ClN4O3S/c17-12-9-11(1-2-13(12)21-5-7-24-8-6-21)19-15(23)10-25-16-18-4-3-14(22)20-16/h1-2,9,16,18H,3-8,10H2,(H,19,23)(H,20,22)