1-(phenylmethyl)sulfonyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(phenylmethyl)sulfonyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide Openeye Name: 1-benzylsulfonyl-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]piperidine-4-carboxamide CAS Name: 1-(phenylmethyl)sulfonyl-N-[4-(2,4,5-trimethylphenyl)-2-thiazolyl]-4-piperidinecarboxamide IUPAC Name: 1-benzylsulfonyl-N-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide Traditional Name: 1-benzylsulfonyl-N-[4-(2,4,5-trimethylphenyl)thiazol-2-yl]isonipecotamide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C25H29N3O3S2/c1-17-13-19(3)22(14-18(17)2)23-15-32-25(26-23)27-24(29)21-9-11-28(12-10-21)33(30,31)16-20-7-5-4-6-8-20/h4-8,13-15,21H,9-12,16H2,1-3H3,(H,26,27,29)