ethyl 4-[[4-(4,4-dimethyl-2-oxidanylidene-1,3-oxazolidin-3-yl)piperidin-1-yl]carbothioylamino]butanoate

Systemtic Name: ethyl 4-[[4-(4,4-dimethyl-2-oxidanylidene-1,3-oxazolidin-3-yl)piperidin-1-yl]carbothioylamino]butanoate Openeye Name: ethyl 4-[[4-(4,4-dimethyl-2-oxo-oxazolidin-3-yl)piperidine-1-carbothioyl]amino]butanoate CAS Name: 4-[[[4-(4,4-dimethyl-2-oxo-3-oxazolidinyl)-1-piperidinyl]-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carbothioyl]amino]butanoate Traditional Name: 4-[[4-(2-keto-4,4-dimethyl-oxazolidin-3-yl)piperidine-1-carbothioyl]amino]butyric acid ethyl ester Formula: C17H29N3O4S MolecularWeight: 371.49486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=S)N1CCC(CC1)N2C(=O)OCC2(C)C

Isomeric SMILES

CCOC(=O)CCCNC(=S)N1CCC(CC1)N2C(=O)OCC2(C)C

InChI

InChI=1S/C17H29N3O4S/c1-4-23-14(21)6-5-9-18-15(25)19-10-7-13(8-11-19)20-16(22)24-12-17(20,2)3/h13H,4-12H2,1-3H3,(H,18,25)