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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4)C

InChI

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