N-[3-(3,3-dimethyl-2-oxidanylidene-butyl)-1,3-benzothiazol-2-ylidene]-4-methoxy-benzamide

Systemtic Name: N-[3-(3,3-dimethyl-2-oxidanylidene-butyl)-1,3-benzothiazol-2-ylidene]-4-methoxy-benzamide Openeye Name: N-[3-(3,3-dimethyl-2-oxo-butyl)-1,3-benzothiazol-2-ylidene]-4-methoxy-benzamide CAS Name: N-[3-(3,3-dimethyl-2-oxobutyl)-1,3-benzothiazol-2-ylidene]-4-methoxybenzamide IUPAC Name: N-[3-(3,3-dimethyl-2-oxobutyl)-1,3-benzothiazol-2-ylidene]-4-methoxybenzamide Traditional Name: N-[3-(2-keto-3,3-dimethyl-butyl)-1,3-benzothiazol-2-ylidene]-4-methoxy-benzamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O3S/c1-21(2,3)18(24)13-23-16-7-5-6-8-17(16)27-20(23)22-19(25)14-9-11-15(26-4)12-10-14/h5-12H,13H2,1-4H3