N-[5-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[5-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonyl-4-methyl-thiophen-2-yl]-3-fluoranyl-benzamide Openeye Name: N-[5-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]-4-methyl-2-thienyl]-3-fluoro-benzamide CAS Name: N-[5-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-oxomethyl]-4-methyl-2-thiophenyl]-3-fluorobenzamide IUPAC Name: N-[5-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1-carbonyl]-4-methylthiophen-2-yl]-3-fluorobenzamide Traditional Name: N-[5-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]-4-methyl-2-thienyl]-3-fluoro-benzamide Formula: C22H21ClFN3O2S2 MolecularWeight: 478.002443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC(=CC=C2)F)C(=O)N3CCN(CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC(=CC=C2)F)C(=O)N3CCN(CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C22H21ClFN3O2S2/c1-14-11-19(25-21(28)15-3-2-4-16(24)12-15)31-20(14)22(29)27-9-7-26(8-10-27)13-17-5-6-18(23)30-17/h2-6,11-12H,7-10,13H2,1H3,(H,25,28)