2-(3-oxidanylidene-2-propan-2-yl-1,2-benzothiazol-1-ium-1-yl)-N-propan-2-yl-benzamide chloride

Systemtic Name: 2-(3-oxidanylidene-2-propan-2-yl-1,2-benzothiazol-1-ium-1-yl)-N-propan-2-yl-benzamide chloride Openeye Name: N-isopropyl-2-(2-isopropyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)benzamide chloride CAS Name: 2-(3-oxo-2-propan-2-yl-1,2-benzothiazol-1-ium-1-yl)-N-propan-2-ylbenzamide chloride IUPAC Name: 2-(3-oxo-2-propan-2-yl-1,2-benzothiazol-1-ium-1-yl)-N-propan-2-ylbenzamide chloride Traditional Name: N-isopropyl-2-(2-isopropyl-3-keto-1,2-benzothiazol-1-ium-1-yl)benzamide chloride Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1[S+]2C3=CC=CC=C3C(=O)N2C(C)C.[Cl-]

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1[S+]2C3=CC=CC=C3C(=O)N2C(C)C.[Cl-]

InChI

InChI=1S/C20H22N2O2S.ClH/c1-13(2)21-19(23)15-9-5-7-11-17(15)25-18-12-8-6-10-16(18)20(24)22(25)14(3)4;/h5-14H,1-4H3;1H