N-[5-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[5-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide Openeye Name: N-[5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[5-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-2-methylphenyl]-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methylphenyl]-1,2-benzothiazole-3-carboxamide Traditional Name: N-[5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-1,2-benzothiazole-3-carboxamide Formula: C26H23FN4O2S MolecularWeight: 474.549823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F)NC(=O)C4=NSC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)F)NC(=O)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C26H23FN4O2S/c1-17-6-7-18(16-22(17)28-25(32)24-21-4-2-3-5-23(21)34-29-24)26(33)31-14-12-30(13-15-31)20-10-8-19(27)9-11-20/h2-11,16H,12-15H2,1H3,(H,28,32)