N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-(isobutyrylamino)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

InChI

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