N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-2-oxidanyl-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxamide

Systemtic Name: N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-2-oxidanyl-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxamide Openeye Name: N-[4-(2-adamantyl)thiazol-2-yl]-1-allyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-[4-(2-adamantyl)-2-thiazolyl]-2-hydroxy-4-oxo-1-prop-2-enyl-3-quinolinecarboxamide IUPAC Name: N-[4-(2-adamantyl)-1,3-thiazol-2-yl]-2-hydroxy-4-oxo-1-prop-2-enylquinoline-3-carboxamide Traditional Name: N-[4-(2-adamantyl)thiazol-2-yl]-1-allyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC(=CS3)C4C5CC6CC(C5)CC4C6

Isomeric SMILES

C=CCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC(=CS3)C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C26H27N3O3S/c1-2-7-29-20-6-4-3-5-18(20)23(30)22(25(29)32)24(31)28-26-27-19(13-33-26)21-16-9-14-8-15(11-16)12-17(21)10-14/h2-6,13-17,21,32H,1,7-12H2,(H,27,28,31)