3-azanyl-5-[4-(diethylcarbamoyl)phenyl]-2-fluoranyl-4-[1-(thiophen-2-ylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 3-azanyl-5-[4-(diethylcarbamoyl)phenyl]-2-fluoranyl-4-[1-(thiophen-2-ylmethyl)piperidin-4-yl]benzamide Openeye Name: 3-amino-5-[4-(diethylcarbamoyl)phenyl]-2-fluoro-4-[1-(2-thienylmethyl)-4-piperidyl]benzamide CAS Name: 3-amino-5-[4-[diethylamino(oxo)methyl]phenyl]-2-fluoro-4-[1-(thiophen-2-ylmethyl)-4-piperidinyl]benzamide IUPAC Name: 3-amino-5-[4-(diethylcarbamoyl)phenyl]-2-fluoro-4-[1-(thiophen-2-ylmethyl)piperidin-4-yl]benzamide Traditional Name: 3-amino-5-[4-(diethylcarbamoyl)phenyl]-2-fluoro-4-[1-(2-thenyl)-4-piperidyl]benzamide Formula: C28H33FN4O2S MolecularWeight: 508.650623

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2=CC(=C(C(=C2C3CCN(CC3)CC4=CC=CS4)N)F)C(=O)N

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2=CC(=C(C(=C2C3CCN(CC3)CC4=CC=CS4)N)F)C(=O)N

InChI

InChI=1S/C28H33FN4O2S/c1-3-33(4-2)28(35)20-9-7-18(8-10-20)22-16-23(27(31)34)25(29)26(30)24(22)19-11-13-32(14-12-19)17-21-6-5-15-36-21/h5-10,15-16,19H,3-4,11-14,17,30H2,1-2H3,(H2,31,34)