N-[4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-(4-chlorophenyl)ethanoylcarbamothioylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[[[2-(4-chlorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[2-(4-chlorophenyl)acetyl]carbamothioylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-(4-chlorophenyl)acetyl]thiocarbamoylamino]phenyl]thiophene-2-carboxamide Formula: C20H16ClN3O2S2 MolecularWeight: 429.94294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H16ClN3O2S2/c21-14-5-3-13(4-6-14)12-18(25)24-20(27)23-16-9-7-15(8-10-16)22-19(26)17-2-1-11-28-17/h1-11H,12H2,(H,22,26)(H2,23,24,25,27)