2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[2-(2-methylpropanoylamino)ethyl]benzamide

Systemtic Name: 2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[2-(2-methylpropanoylamino)ethyl]benzamide Openeye Name: 2-[2-(cyclohexylmethylamino)-2-oxo-ethyl]sulfanyl-N-[2-(2-methylpropanoylamino)ethyl]benzamide CAS Name: 2-[[2-(cyclohexylmethylamino)-2-oxoethyl]thio]-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]benzamide IUPAC Name: 2-[2-(cyclohexylmethylamino)-2-oxoethyl]sulfanyl-N-[2-(2-methylpropanoylamino)ethyl]benzamide Traditional Name: 2-[[2-(cyclohexylmethylamino)-2-keto-ethyl]thio]-N-[2-(isobutyrylamino)ethyl]benzamide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC=CC=C1SCC(=O)NCC2CCCCC2

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC=CC=C1SCC(=O)NCC2CCCCC2

InChI

InChI=1S/C22H33N3O3S/c1-16(2)21(27)23-12-13-24-22(28)18-10-6-7-11-19(18)29-15-20(26)25-14-17-8-4-3-5-9-17/h6-7,10-11,16-17H,3-5,8-9,12-15H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)