(5S,7R)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-3-hydroxy-N-(4-methyl-1,3-benzothiazol-2-yl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-hydroxy-N-(4-methyl-1,3-benzothiazol-2-yl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-hydroxy-N-(4-methyl-1,3-benzothiazol-2-yl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-hydroxy-N-(4-methyl-1,3-benzothiazol-2-yl)adamantane-1-carboxamide Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C34C[C@H]5C[C@@H](C3)CC(C5)(C4)O

InChI

InChI=1S/C19H22N2O2S/c1-11-3-2-4-14-15(11)20-17(24-14)21-16(22)18-6-12-5-13(7-18)9-19(23,8-12)10-18/h2-4,12-13,23H,5-10H2,1H3,(H,20,21,22)/t12-,13+,18?,19?