3-bromanyl-N-[[4-(diethylamino)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[4-(diethylamino)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: 3-bromo-N-[[4-(diethylamino)phenyl]carbamothioyl]-4-isopentyloxy-benzamide CAS Name: 3-bromo-N-[[4-(diethylamino)anilino]-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: 3-bromo-N-[[4-(diethylamino)phenyl]carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 3-bromo-N-[[4-(diethylamino)phenyl]thiocarbamoyl]-4-isoamoxy-benzamide Formula: C23H30BrN3O2S MolecularWeight: 492.4722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br

InChI

InChI=1S/C23H30BrN3O2S/c1-5-27(6-2)19-10-8-18(9-11-19)25-23(30)26-22(28)17-7-12-21(20(24)15-17)29-14-13-16(3)4/h7-12,15-16H,5-6,13-14H2,1-4H3,(H2,25,26,28,30)