2-chloranyl-1-(2-methyl-1,3-benzothiazol-6-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one

Systemtic Name: 2-chloranyl-1-(2-methyl-1,3-benzothiazol-6-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one Openeye Name: 3-(1-benzyl-4-piperidyl)-2-chloro-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one CAS Name: 2-chloro-1-(2-methyl-1,3-benzothiazol-6-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone IUPAC Name: 3-(1-benzylpiperidin-4-yl)-2-chloro-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one Traditional Name: 3-(1-benzyl-4-piperidyl)-2-chloro-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one Formula: C23H25ClN2OS MolecularWeight: 412.9754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)C(=O)C(CC3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)C(=O)C(CC3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H25ClN2OS/c1-16-25-21-8-7-19(14-22(21)28-16)23(27)20(24)13-17-9-11-26(12-10-17)15-18-5-3-2-4-6-18/h2-8,14,17,20H,9-13,15H2,1H3