methyl N-[[2-[C-(4-chlorophenyl)carbonimidoyl]-5-propylsulfanyl-phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-[C-(4-chlorophenyl)carbonimidoyl]-5-propylsulfanyl-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(4-chlorobenzenecarboximidoyl)-5-propylsulfanyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[(4-chlorophenyl)-iminomethyl]-5-(propylthio)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(4-chlorobenzenecarboximidoyl)-5-propylsulfanylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(4-chlorobenzimidoyl)-5-(propylthio)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)C(=N)C2=CC=C(C=C2)Cl)NC(=S)NC(=O)OC

Isomeric SMILES

CCCSC1=CC(=C(C=C1)C(=N)C2=CC=C(C=C2)Cl)NC(=S)NC(=O)OC

InChI

InChI=1S/C19H20ClN3O2S2/c1-3-10-27-14-8-9-15(17(21)12-4-6-13(20)7-5-12)16(11-14)22-18(26)23-19(24)25-2/h4-9,11,21H,3,10H2,1-2H3,(H2,22,23,24,26)