ethyl 2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[4-[(4-methoxyphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H25N3O5S3 MolecularWeight: 567.6995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25N3O5S3/c1-3-35-26(31)23-17-24(18-7-5-4-6-8-18)37-25(23)29-27(36)28-19-11-15-22(16-12-19)38(32,33)30-20-9-13-21(34-2)14-10-20/h4-17,30H,3H2,1-2H3,(H2,28,29,36)