1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-chloranylphenoxy)propan-1-one

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-chloranylphenoxy)propan-1-one Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(4-chlorophenoxy)propan-1-one CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-(4-chlorophenoxy)-1-propanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(4-chlorophenoxy)propan-1-one Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-(4-chlorophenoxy)propan-1-one Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC(C1)C2=NC3=CC=CC=C3S2)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)N1CCCC(C1)C2=NC3=CC=CC=C3S2)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN2O2S/c1-14(26-17-10-8-16(22)9-11-17)21(25)24-12-4-5-15(13-24)20-23-18-6-2-3-7-19(18)27-20/h2-3,6-11,14-15H,4-5,12-13H2,1H3