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

Systemtic Name: 3-ethylsulfanyl-2-phenyl-8-(phenylsulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene Openeye Name: 8-(benzenesulfonyl)-3-ethylsulfanyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene CAS Name: 8-(benzenesulfonyl)-3-(ethylthio)-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene IUPAC Name: 8-(benzenesulfonyl)-3-ethylsulfanyl-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Traditional Name: 8-besyl-3-(ethylthio)-2-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N=C1C4=CC=CC=C4

Isomeric SMILES

CCSC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)N=C1C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S2/c1-2-27-20-19(17-9-5-3-6-10-17)22-21(23-20)13-15-24(16-14-21)28(25,26)18-11-7-4-8-12-18/h3-12H,2,13-16H2,1H3