N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[1-(2-methylpropanoyl)-4-piperidyl]-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-[1-(2-methylpropanoyl)piperidin-4-yl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(1-isobutyryl-4-piperidyl)-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C21H27N3O2S2/c1-14(2)20(26)24-10-8-18(9-11-24)23-19(25)17-6-4-16(5-7-17)13-28-21-22-15(3)12-27-21/h4-7,12,14,18H,8-11,13H2,1-3H3,(H,23,25)