4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]butan-1-one Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCCC2=NC3=CC=CC=C3S2)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)CCCC2=NC3=CC=CC=C3S2)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H24N2O3S/c26-23(9-3-8-22-24-17-5-1-2-7-21(17)29-22)25-12-4-6-18(25)16-10-11-19-20(15-16)28-14-13-27-19/h1-2,5,7,10-11,15,18H,3-4,6,8-9,12-14H2