4-(2-ethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(2-ethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(2-ethyl-1-piperidyl)sulfonyl]-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(2-ethyl-1-piperidinyl)sulfonyl]-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-(2-ethylpiperidin-1-yl)sulfonyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(2-ethylpiperidino)sulfonyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C22H25N3O3S3 MolecularWeight: 475.6472

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=CC=C4SC

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=CC=C4SC

InChI

InChI=1S/C22H25N3O3S3/c1-3-16-7-4-5-14-25(16)31(27,28)17-12-10-15(11-13-17)21(26)24-22-23-20-18(29-2)8-6-9-19(20)30-22/h6,8-13,16H,3-5,7,14H2,1-2H3,(H,23,24,26)