methyl 2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[[2-[(3,4-dichlorophenyl)methylthio]-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[[2-[(3,4-dichlorobenzyl)thio]acetyl]amino]thiocarbamoylamino]-5-ethyl-thiophene-3-carboxylic acid methyl ester Formula: C18H19Cl2N3O3S3 MolecularWeight: 492.46276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NNC(=O)CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NNC(=O)CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)OC

InChI

InChI=1S/C18H19Cl2N3O3S3/c1-3-11-7-12(17(25)26-2)16(29-11)21-18(27)23-22-15(24)9-28-8-10-4-5-13(19)14(20)6-10/h4-7H,3,8-9H2,1-2H3,(H,22,24)(H2,21,23,27)