2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(phenylmethylidene)-1,3-thiazol-4-one

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(phenylmethylidene)-1,3-thiazol-4-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-5-benzylidene-thiazol-4-one CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-5-(phenylmethylene)-4-thiazolone IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-5-benzylidene-1,3-thiazol-4-one Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-5-benzal-2-thiazolin-4-one Formula: C18H20N2O2S2 MolecularWeight: 360.4936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC(=O)C(=CC3=CC=CC=C3)S2

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC(=O)C(=CC3=CC=CC=C3)S2

InChI

InChI=1S/C18H20N2O2S2/c21-16(20-10-6-1-2-7-11-20)13-23-18-19-17(22)15(24-18)12-14-8-4-3-5-9-14/h3-5,8-9,12H,1-2,6-7,10-11,13H2