N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-2-methyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-2-methyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(C(C)C)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC(C(C)C)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H25N3O3S2/c1-14(2)21(22(26)25-11-10-16-6-4-5-7-17(16)13-25)24-30(27,28)18-8-9-19-20(12-18)29-15(3)23-19/h4-9,12,14,21,24H,10-11,13H2,1-3H3