5-(4-methylphenyl)sulfonyl-4-phenyl-1,5-diazocan-2-one

Systemtic Name: 5-(4-methylphenyl)sulfonyl-4-phenyl-1,5-diazocan-2-one Openeye Name: 4-phenyl-5-(p-tolylsulfonyl)-1,5-diazocan-2-one CAS Name: 5-(4-methylphenyl)sulfonyl-4-phenyl-1,5-diazocan-2-one IUPAC Name: 5-(4-methylphenyl)sulfonyl-4-phenyl-1,5-diazocan-2-one Traditional Name: 4-phenyl-5-tosyl-1,5-diazocan-2-one Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCNC(=O)CC2C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCNC(=O)CC2C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3S/c1-15-8-10-17(11-9-15)25(23,24)21-13-5-12-20-19(22)14-18(21)16-6-3-2-4-7-16/h2-4,6-11,18H,5,12-14H2,1H3,(H,20,22)