[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazino]-(3-fluoro-4-methoxy-phenyl)methanone Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C20H20FN3O2S/c1-26-17-7-6-14(12-15(17)21)20(25)24-10-8-23(9-11-24)13-19-22-16-4-2-3-5-18(16)27-19/h2-7,12H,8-11,13H2,1H3