2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]benzenecarbothioamide

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]benzenecarbothioamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethoxy]benzenecarbothioamide CAS Name: 2-[2-(1-azepanyl)-2-oxoethoxy]benzenecarbothioamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethoxy]benzenecarbothioamide Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethoxy]thiobenzamide Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC=CC=C2C(=S)N

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C15H20N2O2S/c16-15(20)12-7-3-4-8-13(12)19-11-14(18)17-9-5-1-2-6-10-17/h3-4,7-8H,1-2,5-6,9-11H2,(H2,16,20)