4-[(1-ethylpiperidin-4-yl)methyl]-6-(methylamino)-1,4-thiazepan-5-one

Systemtic Name: 4-[(1-ethylpiperidin-4-yl)methyl]-6-(methylamino)-1,4-thiazepan-5-one Openeye Name: 4-[(1-ethyl-4-piperidyl)methyl]-6-(methylamino)-1,4-thiazepan-5-one CAS Name: 4-[(1-ethyl-4-piperidinyl)methyl]-6-(methylamino)-1,4-thiazepan-5-one IUPAC Name: 4-[(1-ethylpiperidin-4-yl)methyl]-6-(methylamino)-1,4-thiazepan-5-one Traditional Name: 4-[(1-ethyl-4-piperidyl)methyl]-6-(methylamino)-1,4-thiazepan-5-one Formula: C14H27N3OS MolecularWeight: 285.44868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)CN2CCSCC(C2=O)NC

Isomeric SMILES

CCN1CCC(CC1)CN2CCSCC(C2=O)NC

InChI

InChI=1S/C14H27N3OS/c1-3-16-6-4-12(5-7-16)10-17-8-9-19-11-13(15-2)14(17)18/h12-13,15H,3-11H2,1-2H3