N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)adamantane-1-carboxamide

Systemtic Name: N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)adamantane-1-carboxamide Openeye Name: N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)adamantane-1-carboxamide CAS Name: N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)-1-adamantanecarboxamide IUPAC Name: N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)adamantane-1-carboxamide Traditional Name: N-(2-acetamido-4-methoxy-1,3-benzothiazol-6-yl)adamantane-1-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(C=C(C=C2S1)NC(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

CC(=O)NC1=NC2=C(C=C(C=C2S1)NC(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C21H25N3O3S/c1-11(25)22-20-24-18-16(27-2)6-15(7-17(18)28-20)23-19(26)21-8-12-3-13(9-21)5-14(4-12)10-21/h6-7,12-14H,3-5,8-10H2,1-2H3,(H,23,26)(H,22,24,25)