N-[4-(cyclohexylcarbamothioylamino)-2,5-diethoxy-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-diethoxy-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-diethoxy-phenyl]-3-fluoro-benzamide CAS Name: N-[4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-2,5-diethoxyphenyl]-3-fluorobenzamide IUPAC Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-diethoxyphenyl]-3-fluorobenzamide Traditional Name: N-[4-(cyclohexylthiocarbamoylamino)-2,5-diethoxy-phenyl]-3-fluoro-benzamide Formula: C24H30FN3O3S MolecularWeight: 459.576703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)F)OCC)NC(=S)NC3CCCCC3

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC(=CC=C2)F)OCC)NC(=S)NC3CCCCC3

InChI

InChI=1S/C24H30FN3O3S/c1-3-30-21-15-20(28-24(32)26-18-11-6-5-7-12-18)22(31-4-2)14-19(21)27-23(29)16-9-8-10-17(25)13-16/h8-10,13-15,18H,3-7,11-12H2,1-2H3,(H,27,29)(H2,26,28,32)