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

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-methoxyphenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(4-methoxyphenyl)sulfanyl-propan-1-one CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-[(4-methoxyphenyl)thio]-1-propanone IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-methoxyphenyl)sulfanylpropan-1-one Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-3-[(4-methoxyphenyl)thio]propan-1-one Formula: C22H24N2O2S2 MolecularWeight: 412.56816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)SCCC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S2/c1-26-17-6-8-18(9-7-17)27-15-12-21(25)24-13-10-16(11-14-24)22-23-19-4-2-3-5-20(19)28-22/h2-9,16H,10-15H2,1H3