methyl 1-[(4-fluoranyl-1-benzothiophen-2-yl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(4-fluoranyl-1-benzothiophen-2-yl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(4-fluorobenzothiophene-2-carbonyl)amino]cyclohexanecarboxylate CAS Name: 1-[[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-fluoro-1-benzothiophene-2-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(4-fluorobenzothiophene-2-carbonyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C17H18FNO3S MolecularWeight: 335.393123

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C17H18FNO3S/c1-22-16(21)17(8-3-2-4-9-17)19-15(20)14-10-11-12(18)6-5-7-13(11)23-14/h5-7,10H,2-4,8-9H2,1H3,(H,19,20)