butane; ethane; 2-pentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one

Systemtic Name: butane; ethane; 2-pentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one Openeye Name: 5-allyl-2-pentylsulfanyl-6-phenyl-hexahydropyrimidin-4-one; butane; ethane CAS Name: butane; ethane; 2-(pentylthio)-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one IUPAC Name: butane; ethane; 2-pentylsulfanyl-6-phenyl-5-prop-2-enyl-1,3-diazinan-4-one Traditional Name: 5-allyl-2-(amylthio)-6-phenyl-hexahydropyrimidin-4-one; ethane; n-butane Formula: C26H48N2OS MolecularWeight: 436.73712

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Descriptors Computed from Structure

Canonical SMILES:

CC.CC.CCCC.CCCCCSC1NC(C(C(=O)N1)CC=C)C2=CC=CC=C2

Isomeric SMILES

CC.CC.CCCC.CCCCCSC1NC(C(C(=O)N1)CC=C)C2=CC=CC=C2

InChI

InChI=1S/C18H26N2OS.C4H10.2C2H6/c1-3-5-9-13-22-18-19-16(14-11-7-6-8-12-14)15(10-4-2)17(21)20-18;1-3-4-2;2*1-2/h4,6-8,11-12,15-16,18-19H,2-3,5,9-10,13H2,1H3,(H,20,21);3-4H2,1-2H3;2*1-2H3