1-ethyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzimidazol-2-one

Systemtic Name: 1-ethyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzimidazol-2-one Openeye Name: 1-ethyl-3-[2-oxo-2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]ethyl]benzimidazol-2-one CAS Name: 1-ethyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]-2-benzimidazolone IUPAC Name: 1-ethyl-3-[2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-2-oxoethyl]benzimidazol-2-one Traditional Name: 1-ethyl-3-[2-keto-2-(4-tosyl-1,4-diazepan-1-yl)ethyl]benzimidazol-2-one Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H28N4O4S/c1-3-26-20-7-4-5-8-21(20)27(23(26)29)17-22(28)24-13-6-14-25(16-15-24)32(30,31)19-11-9-18(2)10-12-19/h4-5,7-12H,3,6,13-17H2,1-2H3