4-(3-methylpiperidin-1-yl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidyl)sulfonyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-4-(3-methylpiperidino)sulfonyl-N-(3-pyridylmethyl)benzamide Formula: C29H32N4O3S2 MolecularWeight: 548.71938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CN=CC=C3)C4=NC5=C(C=CC=C5S4)C(C)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CC3=CN=CC=C3)C4=NC5=C(C=CC=C5S4)C(C)C

InChI

InChI=1S/C29H32N4O3S2/c1-20(2)25-9-4-10-26-27(25)31-29(37-26)33(19-22-8-5-15-30-17-22)28(34)23-11-13-24(14-12-23)38(35,36)32-16-6-7-21(3)18-32/h4-5,8-15,17,20-21H,6-7,16,18-19H2,1-3H3