N-tert-butyl-2-(3-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonyl-7-oxidanylidene-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-(3-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonyl-7-oxidanylidene-1,4-diazepan-1-yl]ethanamide Openeye Name: N-tert-butyl-2-(3-methoxyphenyl)-2-[7-oxo-4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-tert-butyl-2-(3-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonyl-7-oxo-1,4-diazepan-1-yl]acetamide IUPAC Name: N-tert-butyl-2-(3-methoxyphenyl)-2-[4-(4-methylphenyl)sulfonyl-7-oxo-1,4-diazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-(7-keto-4-tosyl-1,4-diazepan-1-yl)-2-(3-methoxyphenyl)acetamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)N(CC2)C(C3=CC(=CC=C3)OC)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)N(CC2)C(C3=CC(=CC=C3)OC)C(=O)NC(C)(C)C

InChI

InChI=1S/C25H33N3O5S/c1-18-9-11-21(12-10-18)34(31,32)27-14-13-22(29)28(16-15-27)23(24(30)26-25(2,3)4)19-7-6-8-20(17-19)33-5/h6-12,17,23H,13-16H2,1-5H3,(H,26,30)