N-[[4-(diethylamino)phenyl]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[4-(diethylamino)anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[4-(diethylamino)phenyl]thiocarbamoyl]benzamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O2S/c1-4-7-8-17-28-21-15-9-18(10-16-21)22(27)25-23(29)24-19-11-13-20(14-12-19)26(5-2)6-3/h9-16H,4-8,17H2,1-3H3,(H2,24,25,27,29)