N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-7-(diethylamino)-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-7-(diethylamino)-2-oxo-chromene-3-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-7-(diethylamino)-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-7-(diethylamino)-2-oxochromene-3-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-7-(diethylamino)-2-keto-chromene-3-carboxamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H31N3O3S/c1-3-30(4-2)20-6-5-19-10-21(25(32)33-22(19)11-20)24(31)29-26-28-23(15-34-26)27-12-16-7-17(13-27)9-18(8-16)14-27/h5-6,10-11,15-18H,3-4,7-9,12-14H2,1-2H3,(H,28,29,31)