methyl N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]carbamate

Systemtic Name: methyl N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]carbamate Openeye Name: methyl N-[4-[2-(azepan-1-yl)-2-oxo-ethyl]thiazol-2-yl]carbamate CAS Name: N-[4-[2-(1-azepanyl)-2-oxoethyl]-2-thiazolyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[2-(azepan-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]carbamate Traditional Name: N-[4-[2-(azepan-1-yl)-2-keto-ethyl]thiazol-2-yl]carbamic acid methyl ester Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC(=CS1)CC(=O)N2CCCCCC2

Isomeric SMILES

COC(=O)NC1=NC(=CS1)CC(=O)N2CCCCCC2

InChI

InChI=1S/C13H19N3O3S/c1-19-13(18)15-12-14-10(9-20-12)8-11(17)16-6-4-2-3-5-7-16/h9H,2-8H2,1H3,(H,14,15,18)