N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[5-methyl-4-(4-propylphenyl)-2-thiazolyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[5-methyl-4-(4-propylphenyl)-1,3-thiazol-2-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[5-methyl-4-(4-propylphenyl)thiazol-2-yl]isonipecotamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C20H27N3O3S2/c1-4-5-15-6-8-16(9-7-15)18-14(2)27-20(21-18)22-19(24)17-10-12-23(13-11-17)28(3,25)26/h6-9,17H,4-5,10-13H2,1-3H3,(H,21,22,24)