N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(4-bromo-2-iodo-phenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[(4-bromo-2-iodoanilino)-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(4-bromo-2-iodophenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-bromo-2-iodo-phenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C17H16BrIN2O2S MolecularWeight: 519.19461

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)I

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)Br)I

InChI

InChI=1S/C17H16BrIN2O2S/c1-2-8-23-13-5-3-4-11(9-13)16(22)21-17(24)20-15-7-6-12(18)10-14(15)19/h3-7,9-10H,2,8H2,1H3,(H2,20,21,22,24)