methyl N-[[2-azanyl-4-(4-fluorophenyl)sulfanyl-phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-azanyl-4-(4-fluorophenyl)sulfanyl-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-amino-4-(4-fluorophenyl)sulfanyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-amino-4-[(4-fluorophenyl)thio]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-amino-4-(4-fluorophenyl)sulfanylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-amino-4-[(4-fluorophenyl)thio]phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C15H14FN3O2S2 MolecularWeight: 351.418963

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=C(C=C2)F)N

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=C(C=C2)F)N

InChI

InChI=1S/C15H14FN3O2S2/c1-21-15(20)19-14(22)18-13-7-6-11(8-12(13)17)23-10-4-2-9(16)3-5-10/h2-8H,17H2,1H3,(H2,18,19,20,22)