2-methyl-8-(3-methylsulfonylphenyl)sulfonyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene

Systemtic Name: 2-methyl-8-(3-methylsulfonylphenyl)sulfonyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Openeye Name: 2-methyl-8-(3-methylsulfonylphenyl)sulfonyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene CAS Name: 2-methyl-8-(3-methylsulfonylphenyl)sulfonyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene IUPAC Name: 2-methyl-8-(3-methylsulfonylphenyl)sulfonyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Traditional Name: 8-(3-mesylphenyl)sulfonyl-2-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C)N=C1C4=CC=CC=C4

Isomeric SMILES

CC1=NC2(CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C)N=C1C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4S2/c1-16-20(17-7-4-3-5-8-17)23-21(22-16)11-13-24(14-12-21)30(27,28)19-10-6-9-18(15-19)29(2,25)26/h3-10,15H,11-14H2,1-2H3