3-[2-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-[4-[4-(3-bromophenyl)thiazol-2-yl]-1-piperidyl]-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-[4-[4-(3-bromophenyl)-2-thiazolyl]-1-piperidinyl]-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-[4-[4-(3-bromophenyl)thiazol-2-yl]piperidino]-2-keto-ethyl]phthalide Formula: C24H21BrN2O3S MolecularWeight: 497.40414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C3=CC(=CC=C3)Br)C(=O)CC4C5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C3=CC(=CC=C3)Br)C(=O)CC4C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C24H21BrN2O3S/c25-17-5-3-4-16(12-17)20-14-31-23(26-20)15-8-10-27(11-9-15)22(28)13-21-18-6-1-2-7-19(18)24(29)30-21/h1-7,12,14-15,21H,8-11,13H2