1-(4-methylphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-1-(p-tolylsulfonyl)-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)-1-tosyl-isonipecotamide Formula: C29H32N4O3S2 MolecularWeight: 548.71938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=CC=C5S4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=CC=N3)C4=NC5=C(C=CC=C5S4)C(C)C

InChI

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