2-butylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one; ethane; propane

Systemtic Name: 2-butylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one; ethane; propane Openeye Name: 5-allyl-2-butylsulfanyl-6-phenyl-hexahydropyrimidin-4-one; ethane; propane CAS Name: 2-(butylthio)-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one; ethane; propane IUPAC Name: 2-butylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one; ethane; propane Traditional Name: 5-allyl-2-(butylthio)-6-phenyl-hexahydropyrimidin-4-one; ethane; n-propane Formula: C22H38N2OS MolecularWeight: 378.61492

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCC.CCCCSC1NC(C(C(=O)N1)CC=C)C2=CC=CC=C2

Isomeric SMILES

CC.CCC.CCCCSC1NC(C(C(=O)N1)CC=C)C2=CC=CC=C2

InChI

InChI=1S/C17H24N2OS.C3H8.C2H6/c1-3-5-12-21-17-18-15(13-10-7-6-8-11-13)14(9-4-2)16(20)19-17;1-3-2;1-2/h4,6-8,10-11,14-15,17-18H,2-3,5,9,12H2,1H3,(H,19,20);3H2,1-2H3;1-2H3