4-[(3-bromophenyl)carbamothioylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[(3-bromophenyl)carbamothioylamino]-N,N-diethyl-benzamide Openeye Name: 4-[(3-bromophenyl)carbamothioylamino]-N,N-diethyl-benzamide CAS Name: 4-[[(3-bromoanilino)-sulfanylidenemethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[(3-bromophenyl)carbamothioylamino]-N,N-diethylbenzamide Traditional Name: 4-[(3-bromophenyl)thiocarbamoylamino]-N,N-diethyl-benzamide Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C18H20BrN3OS/c1-3-22(4-2)17(23)13-8-10-15(11-9-13)20-18(24)21-16-7-5-6-14(19)12-16/h5-12H,3-4H2,1-2H3,(H2,20,21,24)