2-chloranyl-N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[4-[[(3S)-3-methyl-1-piperidyl]methyl]thiazol-2-yl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[4-[[(3S)-3-methyl-1-piperidinyl]methyl]-2-thiazolyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[4-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[4-[[(3S)-3-methylpiperidino]methyl]thiazol-2-yl]-5-(methylthio)benzamide Formula: C18H22ClN3OS2 MolecularWeight: 395.96978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3OS2/c1-12-4-3-7-22(9-12)10-13-11-25-18(20-13)21-17(23)15-8-14(24-2)5-6-16(15)19/h5-6,8,11-12H,3-4,7,9-10H2,1-2H3,(H,20,21,23)/t12-/m0/s1