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

Systemtic Name: 3-chloranyl-N-[4-(pentanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 3-chloro-N-[4-(pentanoylcarbamothioylamino)phenyl]benzamide CAS Name: 3-chloro-N-[4-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-(pentanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 3-chloro-N-[4-(valerylthiocarbamoylamino)phenyl]benzamide Formula: C19H20ClN3O2S MolecularWeight: 389.899

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O2S/c1-2-3-7-17(24)23-19(26)22-16-10-8-15(9-11-16)21-18(25)13-5-4-6-14(20)12-13/h4-6,8-12H,2-3,7H2,1H3,(H,21,25)(H2,22,23,24,26)