2-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(3-methylbutanoylamino)phenyl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[4-(3-methylbutanoylamino)phenyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[4-(3-methylbutanoylamino)phenyl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[4-(isovalerylamino)phenyl]-5-(methylthio)benzamide Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O2S/c1-12(2)10-18(23)21-13-4-6-14(7-5-13)22-19(24)16-11-15(25-3)8-9-17(16)20/h4-9,11-12H,10H2,1-3H3,(H,21,23)(H,22,24)