1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone

Systemtic Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone Openeye Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone CAS Name: 1-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-2-(4-chloro-3-methylphenoxy)ethanone IUPAC Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-(4-chloro-3-methylphenoxy)ethanone Traditional Name: 1-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-(4-chloro-3-methyl-phenoxy)ethanone Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N2CCCC2C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N2CCCC2C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H19ClN2O2S/c1-13-11-14(8-9-15(13)21)25-12-19(24)23-10-4-6-17(23)20-22-16-5-2-3-7-18(16)26-20/h2-3,5,7-9,11,17H,4,6,10,12H2,1H3