2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(4-methylcyclohexyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(4-methylcyclohexyl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(4-methylcyclohexyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(4-methylcyclohexyl)acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(4-methylcyclohexyl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(4-methylcyclohexyl)acetamide Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1CCC(CC1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H25NO3S/c1-13-3-5-14(6-4-13)19-18(20)12-23-15-7-8-16-17(11-15)22-10-2-9-21-16/h7-8,11,13-14H,2-6,9-10,12H2,1H3,(H,19,20)