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

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-chloranyl-4-methyl-phenyl)propan-1-one Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(3-chloro-4-methyl-phenyl)propan-1-one CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(3-chloro-4-methylphenyl)-1-propanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-chloro-4-methylphenyl)propan-1-one Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-3-(3-chloro-4-methyl-phenyl)propan-1-one Formula: C22H23ClN2OS MolecularWeight: 398.94882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H23ClN2OS/c1-15-6-7-16(14-18(15)23)8-9-21(26)25-12-10-17(11-13-25)22-24-19-4-2-3-5-20(19)27-22/h2-7,14,17H,8-13H2,1H3