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

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-7-ethoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-7-ethoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-7-ethoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-7-ethoxy-2-oxochromene-3-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-7-ethoxy-2-keto-chromene-3-carboxamide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC3=NC(=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H26N2O4S/c1-2-30-18-4-3-17-8-19(23(29)31-20(17)9-18)22(28)27-24-26-21(13-32-24)25-10-14-5-15(11-25)7-16(6-14)12-25/h3-4,8-9,13-16H,2,5-7,10-12H2,1H3,(H,26,27,28)