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

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(4-methylphenyl)sulfonyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-1-tosyl-isonipecotamide Formula: C30H33N3O3S2 MolecularWeight: 547.73132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=CC=C3)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=C3)C4=NC5=C(C=CC=C5S4)C(C)C

InChI

InChI=1S/C30H33N3O3S2/c1-21(2)26-10-7-11-27-28(26)31-30(37-27)33(20-23-8-5-4-6-9-23)29(34)24-16-18-32(19-17-24)38(35,36)25-14-12-22(3)13-15-25/h4-15,21,24H,16-20H2,1-3H3