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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

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