methyl N-[[2-azanyl-5-(4-methylsulfinylphenoxy)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-azanyl-5-(4-methylsulfinylphenoxy)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-amino-5-(4-methylsulfinylphenoxy)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-amino-5-(4-methylsulfinylphenoxy)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-amino-5-(4-methylsulfinylphenoxy)phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-amino-5-(4-methylsulfinylphenoxy)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=CC(=C1)OC2=CC=C(C=C2)S(=O)C)N

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=CC(=C1)OC2=CC=C(C=C2)S(=O)C)N

InChI

InChI=1S/C16H17N3O4S2/c1-22-16(20)19-15(24)18-14-9-11(5-8-13(14)17)23-10-3-6-12(7-4-10)25(2)21/h3-9H,17H2,1-2H3,(H2,18,19,20,24)