N-[[4-(butanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-4-methoxy-benzamide CAS Name: 4-methoxy-N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-4-methoxybenzamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C19H21N3O3S MolecularWeight: 371.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H21N3O3S/c1-3-4-17(23)20-14-7-9-15(10-8-14)21-19(26)22-18(24)13-5-11-16(25-2)12-6-13/h5-12H,3-4H2,1-2H3,(H,20,23)(H2,21,22,24,26)