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

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-hexyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-hexyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-1-hexyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-1-hexyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-1-hexyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C29H35N3O3S MolecularWeight: 505.6715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H35N3O3S/c1-2-3-4-7-10-32-22-9-6-5-8-21(22)25(33)24(27(32)35)26(34)31-28-30-23(17-36-28)29-14-18-11-19(15-29)13-20(12-18)16-29/h5-6,8-9,17-20,35H,2-4,7,10-16H2,1H3,(H,30,31,34)