(3,3-dimethylazepan-1-yl)-[5-(oxan-4-yl)thiophen-3-yl]methanone

Systemtic Name: (3,3-dimethylazepan-1-yl)-[5-(oxan-4-yl)thiophen-3-yl]methanone Openeye Name: (3,3-dimethylazepan-1-yl)-(5-tetrahydropyran-4-yl-3-thienyl)methanone CAS Name: (3,3-dimethyl-1-azepanyl)-[5-(4-oxanyl)-3-thiophenyl]methanone IUPAC Name: (3,3-dimethylazepan-1-yl)-[5-(oxan-4-yl)thiophen-3-yl]methanone Traditional Name: (3,3-dimethylazepan-1-yl)-(5-tetrahydropyran-4-yl-3-thienyl)methanone Formula: C18H27NO2S MolecularWeight: 321.47748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCN(C1)C(=O)C2=CSC(=C2)C3CCOCC3)C

Isomeric SMILES

CC1(CCCCN(C1)C(=O)C2=CSC(=C2)C3CCOCC3)C

InChI

InChI=1S/C18H27NO2S/c1-18(2)7-3-4-8-19(13-18)17(20)15-11-16(22-12-15)14-5-9-21-10-6-14/h11-12,14H,3-10,13H2,1-2H3