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

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-1-(p-tolylsulfonyl)-N-(tetrahydrofuran-2-ylmethyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(2-oxolanylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-N-(tetrahydrofurfuryl)-1-tosyl-isonipecotamide Formula: C28H35N3O4S2 MolecularWeight: 541.7252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3CCCO3)C4=NC5=C(C=CC=C5S4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3CCCO3)C4=NC5=C(C=CC=C5S4)C(C)C

InChI

InChI=1S/C28H35N3O4S2/c1-19(2)24-7-4-8-25-26(24)29-28(36-25)31(18-22-6-5-17-35-22)27(32)21-13-15-30(16-14-21)37(33,34)23-11-9-20(3)10-12-23/h4,7-12,19,21-22H,5-6,13-18H2,1-3H3