3-methoxy-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-methoxy-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 3-methoxy-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 3-methoxy-N-[[3-(1-oxopentylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-methoxy-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 3-methoxy-N-[[3-(valerylamino)phenyl]thiocarbamoyl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C20H23N3O3S/c1-3-4-11-18(24)21-15-8-6-9-16(13-15)22-20(27)23-19(25)14-7-5-10-17(12-14)26-2/h5-10,12-13H,3-4,11H2,1-2H3,(H,21,24)(H2,22,23,25,27)