N-[4-(4-cyclohexylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-(4-cyclohexylpiperazin-1-yl)carbonyl-1,3-thiazol-2-yl]-3-fluoranyl-benzamide Openeye Name: N-[4-(4-cyclohexylpiperazine-1-carbonyl)thiazol-2-yl]-3-fluoro-benzamide CAS Name: N-[4-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-2-thiazolyl]-3-fluorobenzamide IUPAC Name: N-[4-(4-cyclohexylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]-3-fluorobenzamide Traditional Name: N-[4-(4-cyclohexylpiperazine-1-carbonyl)thiazol-2-yl]-3-fluoro-benzamide Formula: C21H25FN4O2S MolecularWeight: 416.512203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CSC(=N3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H25FN4O2S/c22-16-6-4-5-15(13-16)19(27)24-21-23-18(14-29-21)20(28)26-11-9-25(10-12-26)17-7-2-1-3-8-17/h4-6,13-14,17H,1-3,7-12H2,(H,23,24,27)