N-(1-adamantylmethyl)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-methyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-methyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylacetamide IUPAC Name: N-(1-adamantylmethyl)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-methylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-methyl-acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)CNC4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)CNC4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C21H27N3O3S/c1-24(13-21-9-14-6-15(10-21)8-16(7-14)11-21)19(25)12-22-20-17-4-2-3-5-18(17)28(26,27)23-20/h2-5,14-16H,6-13H2,1H3,(H,22,23)