2,4-bis(chloranyl)-N-[4-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 2,4-dichloro-N-[4-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide CAS Name: 2,4-dichloro-N-[4-[[[(2-methyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2,4-dichloro-N-[4-(2-methylpropanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 2,4-dichloro-N-[4-(isobutyrylthiocarbamoylamino)phenyl]benzamide Formula: C18H17Cl2N3O2S MolecularWeight: 410.31748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17Cl2N3O2S/c1-10(2)16(24)23-18(26)22-13-6-4-12(5-7-13)21-17(25)14-8-3-11(19)9-15(14)20/h3-10H,1-2H3,(H,21,25)(H2,22,23,24,26)