N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-[(2-ethyl-1-piperidyl)sulfonyl]-N-(2-pyridylmethyl)benzamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-[(2-ethyl-1-piperidinyl)sulfonyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(2-ethylpiperidin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-(2-ethylpiperidino)sulfonyl-N-(2-pyridylmethyl)benzamide Formula: C29H32N4O3S2 MolecularWeight: 548.71938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=CC(=C5S4)C)C

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=CC(=C5S4)C)C

InChI

InChI=1S/C29H32N4O3S2/c1-4-24-10-6-8-18-33(24)38(35,36)25-15-13-22(14-16-25)28(34)32(19-23-9-5-7-17-30-23)29-31-26-20(2)11-12-21(3)27(26)37-29/h5,7,9,11-17,24H,4,6,8,10,18-19H2,1-3H3