2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)ethanamide

Systemtic Name: 2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)ethanamide Openeye Name: 2-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide CAS Name: 2-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide IUPAC Name: 2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide Traditional Name: 2-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]sulfonyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CS(=O)(=O)CC(=O)N=C2N(C3=CC=CC=C3S2)CC#C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CS(=O)(=O)CC(=O)N=C2N(C3=CC=CC=C3S2)CC#C)C

InChI

InChI=1S/C21H25N3O4S2/c1-4-9-24-17-7-5-6-8-18(17)29-21(24)22-19(25)13-30(27,28)14-20(26)23-11-15(2)10-16(3)12-23/h1,5-8,15-16H,9-14H2,2-3H3