(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl) 4-ethanoylbenzoate

Systemtic Name: (2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl) 4-ethanoylbenzoate Openeye Name: (2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl) 4-acetylbenzoate CAS Name: 4-acetylbenzoic acid [2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl) 4-acetylbenzoate Traditional Name: 4-acetylbenzoic acid (2-pyrrolidino-1,3-benzothiazol-6-yl) ester Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)N4CCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)N4CCCC4

InChI

InChI=1S/C20H18N2O3S/c1-13(23)14-4-6-15(7-5-14)19(24)25-16-8-9-17-18(12-16)26-20(21-17)22-10-2-3-11-22/h4-9,12H,2-3,10-11H2,1H3