3-butylsulfanyl-2-phenyl-8-(phenylsulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene

Systemtic Name: 3-butylsulfanyl-2-phenyl-8-(phenylsulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene Openeye Name: 8-(benzenesulfonyl)-3-butylsulfanyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene CAS Name: 8-(benzenesulfonyl)-3-(butylthio)-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene IUPAC Name: 8-(benzenesulfonyl)-3-butylsulfanyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Traditional Name: 8-besyl-3-(butylthio)-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N=C1C4=CC=CC=C4

Isomeric SMILES

CCCCSC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N=C1C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S2/c1-2-3-18-29-22-21(19-10-6-4-7-11-19)24-23(25-22)14-16-26(17-15-23)30(27,28)20-12-8-5-9-13-20/h4-13H,2-3,14-18H2,1H3