3-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-[3-(azepan-1-yl)-3-oxo-propyl]-5-benzylidene-2-thioxo-thiazolidin-4-one CAS Name: 3-[3-(1-azepanyl)-3-oxopropyl]-5-(phenylmethylene)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-[3-(azepan-1-yl)-3-oxopropyl]-5-benzylidene-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-[3-(azepan-1-yl)-3-keto-propyl]-5-benzal-2-thioxo-thiazolidin-4-one Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

Isomeric SMILES

C1CCCN(CC1)C(=O)CCN2C(=O)C(=CC3=CC=CC=C3)SC2=S

InChI

InChI=1S/C19H22N2O2S2/c22-17(20-11-6-1-2-7-12-20)10-13-21-18(23)16(25-19(21)24)14-15-8-4-3-5-9-15/h3-5,8-9,14H,1-2,6-7,10-13H2