2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(5-methylisoxazol-3-yl)propionamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H18N2O4S/c1-10-8-15(18-22-10)17-16(19)11(2)23-12-4-5-13-14(9-12)21-7-3-6-20-13/h4-5,8-9,11H,3,6-7H2,1-2H3,(H,17,18,19)