3-chloranyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-chloranyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-chloro-4-methyl-benzamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-3-chloro-4-methylbenzamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-3-chloro-4-methylbenzamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-3-chloro-4-methyl-benzamide Formula: C18H17ClN4O2S2 MolecularWeight: 420.93618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C)Cl

InChI

InChI=1S/C18H17ClN4O2S2/c1-10-3-4-12(9-15(10)19)16(25)23-18(27)22-14-7-5-13(6-8-14)21-17(26)20-11(2)24/h3-9H,1-2H3,(H2,20,21,24,26)(H2,22,23,25,27)