3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzothiazol-2-yl)piperidino]propan-1-one Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N2O3S/c25-21(8-6-15-5-7-18-19(13-15)27-14-26-18)24-11-9-16(10-12-24)22-23-17-3-1-2-4-20(17)28-22/h1-5,7,13,16H,6,8-12,14H2