3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-(furan-3-ylmethylidene)-1,3-thiazolidine-2,4-dione

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-(furan-3-ylmethylidene)-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-(3-furylmethylene)thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-(3-furanylmethylidene)thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-(furan-3-ylmethylidene)-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-(3-furfurylidene)thiazolidine-2,4-quinone Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=COC=C3)SC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=COC=C3)SC2=O

InChI

InChI=1S/C16H18N2O4S/c19-14(17-6-3-1-2-4-7-17)10-18-15(20)13(23-16(18)21)9-12-5-8-22-11-12/h5,8-9,11H,1-4,6-7,10H2