N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: 2,6-dimethoxy-N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C20H23N3O4S/c1-4-7-17(24)21-13-8-5-9-14(12-13)22-20(28)23-19(25)18-15(26-2)10-6-11-16(18)27-3/h5-6,8-12H,4,7H2,1-3H3,(H,21,24)(H2,22,23,25,28)