N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-4-(2-methylpropoxy)benzamide

Systemtic Name: N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-4-(2-methylpropoxy)benzamide Openeye Name: 4-isobutoxy-N-[4-[[(3S)-3-methyl-1-piperidyl]methyl]thiazol-2-yl]benzamide CAS Name: N-[4-[[(3S)-3-methyl-1-piperidinyl]methyl]-2-thiazolyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-4-(2-methylpropoxy)benzamide Traditional Name: 4-isobutoxy-N-[4-[[(3S)-3-methylpiperidino]methyl]thiazol-2-yl]benzamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)OCC(C)C

Isomeric SMILES

C[C@H]1CCCN(C1)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)OCC(C)C

InChI

InChI=1S/C21H29N3O2S/c1-15(2)13-26-19-8-6-17(7-9-19)20(25)23-21-22-18(14-27-21)12-24-10-4-5-16(3)11-24/h6-9,14-16H,4-5,10-13H2,1-3H3,(H,22,23,25)/t16-/m0/s1