2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2,6-diisopropylphenyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[2,6-di(propan-2-yl)phenyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[2,6-di(propan-2-yl)phenyl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(2,6-diisopropylphenyl)acetamide Formula: C23H29NO3S MolecularWeight: 399.54626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C23H29NO3S/c1-15(2)18-7-5-8-19(16(3)4)23(18)24-22(25)14-28-17-9-10-20-21(13-17)27-12-6-11-26-20/h5,7-10,13,15-16H,6,11-12,14H2,1-4H3,(H,24,25)