4-azanyl-3-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-ethyl-benzamide; N-ethylethanamine

Systemtic Name: 4-azanyl-3-[2,4-bis(fluoranyl)phenyl]sulfanyl-N-ethyl-benzamide; N-ethylethanamine Openeye Name: 4-amino-3-(2,4-difluorophenyl)sulfanyl-N-ethyl-benzamide; N-ethylethanamine CAS Name: 4-amino-3-[(2,4-difluorophenyl)thio]-N-ethylbenzamide; N-ethylethanamine IUPAC Name: 4-amino-3-(2,4-difluorophenyl)sulfanyl-N-ethylbenzamide; N-ethylethanamine Traditional Name: 4-amino-3-[(2,4-difluorophenyl)thio]-N-ethyl-benzamide; diethylamine Formula: C19H25F2N3OS MolecularWeight: 381.483106

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CCNC(=O)C1=CC(=C(C=C1)N)SC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCNCC.CCNC(=O)C1=CC(=C(C=C1)N)SC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C15H14F2N2OS.C4H11N/c1-2-19-15(20)9-3-5-12(18)14(7-9)21-13-6-4-10(16)8-11(13)17;1-3-5-4-2/h3-8H,2,18H2,1H3,(H,19,20);5H,3-4H2,1-2H3