2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-ethanamide Openeye Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-(2-thienylmethyl)amino]-N-cyclohexyl-acetamide CAS Name: 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexylacetamide IUPAC Name: 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexylacetamide Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]-(2-thenyl)amino]-N-cyclohexyl-acetamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(CC2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(CC2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H25N3O3S2/c26-20(23-16-7-2-1-3-8-16)14-25(13-17-9-6-12-29-17)21(27)15-30-22-24-18-10-4-5-11-19(18)28-22/h4-6,9-12,16H,1-3,7-8,13-15H2,(H,23,26)