butyl N-[(2-azanyl-4-butylsulfinyl-phenyl)carbamothioyl]carbamate

Systemtic Name: butyl N-[(2-azanyl-4-butylsulfinyl-phenyl)carbamothioyl]carbamate Openeye Name: butyl N-[(2-amino-4-butylsulfinyl-phenyl)carbamothioyl]carbamate CAS Name: N-[(2-amino-4-butylsulfinylanilino)-sulfanylidenemethyl]carbamic acid butyl ester IUPAC Name: butyl N-[(2-amino-4-butylsulfinylphenyl)carbamothioyl]carbamate Traditional Name: N-[(2-amino-4-butylsulfinyl-phenyl)thiocarbamoyl]carbamic acid butyl ester Formula: C16H25N3O3S2 MolecularWeight: 371.518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(=S)NC1=C(C=C(C=C1)S(=O)CCCC)N

Isomeric SMILES

CCCCOC(=O)NC(=S)NC1=C(C=C(C=C1)S(=O)CCCC)N

InChI

InChI=1S/C16H25N3O3S2/c1-3-5-9-22-16(20)19-15(23)18-14-8-7-12(11-13(14)17)24(21)10-6-4-2/h7-8,11H,3-6,9-10,17H2,1-2H3,(H2,18,19,20,23)