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

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[4-(isobutyrylamino)phenyl]thiocarbamoyl]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

InChI

InChI=1S/C23H29N3O3S/c1-4-5-6-15-29-20-13-7-17(8-14-20)22(28)26-23(30)25-19-11-9-18(10-12-19)24-21(27)16(2)3/h7-14,16H,4-6,15H2,1-3H3,(H,24,27)(H2,25,26,28,30)