(5E)-5-[[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]phenyl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]phenyl]methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-5-[4-[4-(1-adamantyl)-2-methyl-1,3-benzoxazol-6-yl]benzylidene]-2-thioxo-thiazolidin-4-one Formula: C28H26N2O2S2 MolecularWeight: 486.64824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2O1)C3=CC=C(C=C3)C=C4C(=O)NC(=S)S4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=NC2=C(C=C(C=C2O1)C3=CC=C(C=C3)/C=C/4\C(=O)NC(=S)S4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C28H26N2O2S2/c1-15-29-25-22(28-12-17-6-18(13-28)8-19(7-17)14-28)10-21(11-23(25)32-15)20-4-2-16(3-5-20)9-24-26(31)30-27(33)34-24/h2-5,9-11,17-19H,6-8,12-14H2,1H3,(H,30,31,33)/b24-9+