methyl N-[(2-acetamido-5-propylsulfanyl-phenyl)carbamothioyl]carbamate

Systemtic Name: methyl N-[(2-acetamido-5-propylsulfanyl-phenyl)carbamothioyl]carbamate Openeye Name: methyl N-[(2-acetamido-5-propylsulfanyl-phenyl)carbamothioyl]carbamate CAS Name: N-[[2-acetamido-5-(propylthio)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2-acetamido-5-propylsulfanylphenyl)carbamothioyl]carbamate Traditional Name: N-[[2-acetamido-5-(propylthio)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)NC(=O)C)NC(=S)NC(=O)OC

Isomeric SMILES

CCCSC1=CC(=C(C=C1)NC(=O)C)NC(=S)NC(=O)OC

InChI

InChI=1S/C14H19N3O3S2/c1-4-7-22-10-5-6-11(15-9(2)18)12(8-10)16-13(21)17-14(19)20-3/h5-6,8H,4,7H2,1-3H3,(H,15,18)(H2,16,17,19,21)