[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)methanone

Systemtic Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-(5-chloranyl-2,3-dihydro-1-benzofuran-2-yl)methanone Openeye Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-(5-chloro-2,3-dihydrobenzofuran-2-yl)methanone CAS Name: [4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-(5-chloro-2,3-dihydrobenzofuran-2-yl)methanone IUPAC Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-(5-chloro-2,3-dihydro-1-benzofuran-2-yl)methanone Traditional Name: [4-(1,2-benzothiazol-3-yl)piperazino]-(5-chlorocoumaran-2-yl)methanone Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=O)C4CC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=NSC3=CC=CC=C32)C(=O)C4CC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C20H18ClN3O2S/c21-14-5-6-16-13(11-14)12-17(26-16)20(25)24-9-7-23(8-10-24)19-15-3-1-2-4-18(15)27-22-19/h1-6,11,17H,7-10,12H2