4-(2-methylpropoxy)-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 4-(2-methylpropoxy)-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-isobutoxy-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide CAS Name: 4-(2-methylpropoxy)-N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-(2-methylpropoxy)-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-isobutoxy-N-[4-(propionylthiocarbamoylamino)phenyl]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C21H25N3O3S/c1-4-19(25)24-21(28)23-17-9-7-16(8-10-17)22-20(26)15-5-11-18(12-6-15)27-13-14(2)3/h5-12,14H,4,13H2,1-3H3,(H,22,26)(H2,23,24,25,28)