N-[3-(dimethylamino)propyl]-2-ethylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-2-ethylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-[3-(dimethylamino)propyl]-2-ethylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-[3-(dimethylamino)propyl]-2-ethylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-[3-(dimethylamino)propyl]-2-ethylsulfonyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-[3-(dimethylamino)propyl]-2-esyl-N-(4-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)C

InChI

InChI=1S/C22H27N3O3S2/c1-5-30(27,28)19-13-7-6-11-17(19)21(26)25(15-9-14-24(3)4)22-23-20-16(2)10-8-12-18(20)29-22/h6-8,10-13H,5,9,14-15H2,1-4H3