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

Systemtic Name: 4-butoxy-N-[[4-(diethylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[4-(diethylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[4-(diethylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[4-(diethylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[4-(diethylamino)phenyl]thiocarbamoyl]benzamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N(CC)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N(CC)CC

InChI

InChI=1S/C22H29N3O2S/c1-4-7-16-27-20-14-8-17(9-15-20)21(26)24-22(28)23-18-10-12-19(13-11-18)25(5-2)6-3/h8-15H,4-7,16H2,1-3H3,(H2,23,24,26,28)