2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide

Systemtic Name: 2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide Openeye Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide CAS Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-[oxo-(2-thiophen-2-ylethylamino)methyl]acetamide IUPAC Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide Traditional Name: 2-[4-[2-(tert-butylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide Formula: C20H33N5O3S MolecularWeight: 423.57272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)CC(=O)NC(=O)NCCC2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)CC(=O)NC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C20H33N5O3S/c1-20(2,3)23-18(27)15-25-10-5-9-24(11-12-25)14-17(26)22-19(28)21-8-7-16-6-4-13-29-16/h4,6,13H,5,7-12,14-15H2,1-3H3,(H,23,27)(H2,21,22,26,28)