3-butylsulfanyl-8-methylsulfonyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene

Systemtic Name: 3-butylsulfanyl-8-methylsulfonyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Openeye Name: 3-butylsulfanyl-8-methylsulfonyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene CAS Name: 3-(butylthio)-8-methylsulfonyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene IUPAC Name: 3-butylsulfanyl-8-methylsulfonyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Traditional Name: 3-(butylthio)-8-mesyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Formula: C18H25N3O2S2 MolecularWeight: 379.54

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2(CCN(CC2)S(=O)(=O)C)N=C1C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NC2(CCN(CC2)S(=O)(=O)C)N=C1C3=CC=CC=C3

InChI

InChI=1S/C18H25N3O2S2/c1-3-4-14-24-17-16(15-8-6-5-7-9-15)19-18(20-17)10-12-21(13-11-18)25(2,22)23/h5-9H,3-4,10-14H2,1-2H3