(5E)-5-[[4-[[4-(9-azaspiro[5.5]undecan-9-ylmethyl)phenyl]methyl]-3-oxidanylidene-1,4-benzoxazin-6-yl]methylidene]-1,3-thiazolidine-2,4-dione

Systemtic Name: (5E)-5-[[4-[[4-(9-azaspiro[5.5]undecan-9-ylmethyl)phenyl]methyl]-3-oxidanylidene-1,4-benzoxazin-6-yl]methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: (5E)-5-[[4-[[4-(9-azaspiro[5.5]undecan-9-ylmethyl)phenyl]methyl]-3-oxo-1,4-benzoxazin-6-yl]methylene]thiazolidine-2,4-dione CAS Name: (5E)-5-[[4-[[4-(9-azaspiro[5.5]undecan-9-ylmethyl)phenyl]methyl]-3-oxo-1,4-benzoxazin-6-yl]methylidene]thiazolidine-2,4-dione IUPAC Name: (5E)-5-[[4-[[4-(9-azaspiro[5.5]undecan-9-ylmethyl)phenyl]methyl]-3-oxo-1,4-benzoxazin-6-yl]methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: (5E)-5-[[4-[4-(9-azaspiro[5.5]undecan-9-ylmethyl)benzyl]-3-keto-1,4-benzoxazin-6-yl]methylene]thiazolidine-2,4-quinone Formula: C30H33N3O4S MolecularWeight: 531.66572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CCN(CC2)CC3=CC=C(C=C3)CN4C(=O)COC5=C4C=C(C=C5)C=C6C(=O)NC(=O)S6

Isomeric SMILES

C1CCC2(CC1)CCN(CC2)CC3=CC=C(C=C3)CN4C(=O)COC5=C4C=C(C=C5)/C=C/6\C(=O)NC(=O)S6

InChI

InChI=1S/C30H33N3O4S/c34-27-20-37-25-9-8-23(17-26-28(35)31-29(36)38-26)16-24(25)33(27)19-22-6-4-21(5-7-22)18-32-14-12-30(13-15-32)10-2-1-3-11-30/h4-9,16-17H,1-3,10-15,18-20H2,(H,31,35,36)/b26-17+