N-(2-diethylaminoethyl)-3-methyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-3-methyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-diethylaminoethyl)-3-methyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-3-methyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-diethylaminoethyl)-3-methyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-3-methyl-benzamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2S(=O)(=O)C)C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C22H27N3O3S2/c1-5-24(6-2)13-14-25(21(26)17-10-7-9-16(3)15-17)22-23-20-18(29-22)11-8-12-19(20)30(4,27)28/h7-12,15H,5-6,13-14H2,1-4H3