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

Systemtic Name: 3-chloranyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C19H15ClN4O2S3 MolecularWeight: 462.996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN4O2S3/c1-10(25)21-18(27)22-11-6-8-12(9-7-11)23-19(28)24-17(26)16-15(20)13-4-2-3-5-14(13)29-16/h2-9H,1H3,(H2,21,22,25,27)(H2,23,24,26,28)