3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(4-pyrrolidin-1-ylnaphthalen-1-yl)methylidene]-1,3-thiazolidine-2,4-dione

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(4-pyrrolidin-1-ylnaphthalen-1-yl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(4-pyrrolidin-1-yl-1-naphthyl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[[4-(1-pyrrolidinyl)-1-naphthalenyl]methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-pyrrolidin-1-ylnaphthalen-1-yl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-[(4-pyrrolidino-1-naphthyl)methylene]thiazolidine-2,4-quinone Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=C(C4=CC=CC=C34)N5CCCC5)SC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=C(C4=CC=CC=C34)N5CCCC5)SC2=O

InChI

InChI=1S/C26H29N3O3S/c30-24(28-15-5-1-2-6-16-28)18-29-25(31)23(33-26(29)32)17-19-11-12-22(27-13-7-8-14-27)21-10-4-3-9-20(19)21/h3-4,9-12,17H,1-2,5-8,13-16,18H2