N-[(4-bromanyl-2-butyl-phenyl)carbamothioyl]benzamide

Systemtic Name: N-[(4-bromanyl-2-butyl-phenyl)carbamothioyl]benzamide Openeye Name: N-[(4-bromo-2-butyl-phenyl)carbamothioyl]benzamide CAS Name: N-[(4-bromo-2-butylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: N-[(4-bromo-2-butylphenyl)carbamothioyl]benzamide Traditional Name: N-[(4-bromo-2-butyl-phenyl)thiocarbamoyl]benzamide Formula: C18H19BrN2OS MolecularWeight: 391.32526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)Br)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C=CC(=C1)Br)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19BrN2OS/c1-2-3-7-14-12-15(19)10-11-16(14)20-18(23)21-17(22)13-8-5-4-6-9-13/h4-6,8-12H,2-3,7H2,1H3,(H2,20,21,22,23)