3-chloranyl-N-[4-(ethanoylcarbamothioylamino)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(ethanoylcarbamothioylamino)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[4-[[acetamido(sulfanylidene)methyl]amino]phenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-(acetylthiocarbamoylamino)phenyl]-3-chloro-benzothiophene-2-carboxamide Formula: C18H14ClN3O2S2 MolecularWeight: 403.90566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H14ClN3O2S2/c1-10(23)20-18(25)22-12-8-6-11(7-9-12)21-17(24)16-15(19)13-4-2-3-5-14(13)26-16/h2-9H,1H3,(H,21,24)(H2,20,22,23,25)