N-[4-(butanoylcarbamothioylamino)phenyl]-3-chloranyl-benzamide

Systemtic Name: N-[4-(butanoylcarbamothioylamino)phenyl]-3-chloranyl-benzamide Openeye Name: N-[4-(butanoylcarbamothioylamino)phenyl]-3-chloro-benzamide CAS Name: 3-chloro-N-[4-[[(1-oxobutylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[4-(butanoylcarbamothioylamino)phenyl]-3-chlorobenzamide Traditional Name: N-[4-(butyrylthiocarbamoylamino)phenyl]-3-chloro-benzamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O2S/c1-2-4-16(23)22-18(25)21-15-9-7-14(8-10-15)20-17(24)12-5-3-6-13(19)11-12/h3,5-11H,2,4H2,1H3,(H,20,24)(H2,21,22,23,25)