4-(azepan-1-ylsulfonyl)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(tert-butylamino)-2-oxo-ethyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(tert-butylamino)-2-oxoethyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(tert-butylamino)-2-oxoethyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[2-(tert-butylamino)-2-keto-ethyl]benzamide Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C19H29N3O4S/c1-19(2,3)21-17(23)14-20-18(24)15-8-10-16(11-9-15)27(25,26)22-12-6-4-5-7-13-22/h8-11H,4-7,12-14H2,1-3H3,(H,20,24)(H,21,23)