N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-12-3-13(2)19-17(4-12)28-21(25-19)24-18(26)11-23-20(27)22-8-14-5-15(9-22)7-16(6-14)10-22/h3-4,14-16H,5-11H2,1-2H3,(H,23,27)(H,24,25,26)