2-(3,5-dimethylpyrazol-1-yl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)ethanamide

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)ethanamide Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)acetamide CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]acetamide IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)acetamide Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)acetamide Formula: C21H27N5O4S2 MolecularWeight: 477.60018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)N(CCN2CCOCC2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C)C

InChI

InChI=1S/C21H27N5O4S2/c1-15-13-16(2)26(23-15)14-19(27)25(8-7-24-9-11-30-12-10-24)21-22-20-17(31-21)5-4-6-18(20)32(3,28)29/h4-6,13H,7-12,14H2,1-3H3