4-butoxy-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[4-(diethylamino)-2-methyl-phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[4-(diethylamino)-2-methylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[[4-(diethylamino)-2-methylphenyl]carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[[4-(diethylamino)-2-methyl-phenyl]thiocarbamoyl]benzamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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