N-[(4-butylphenyl)carbamothioyl]-2-chloranyl-5-iodanyl-benzamide

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-2-chloranyl-5-iodanyl-benzamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-2-chloro-5-iodo-benzamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-2-chloro-5-iodobenzamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-2-chloro-5-iodobenzamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-2-chloro-5-iodo-benzamide Formula: C18H18ClIN2OS MolecularWeight: 472.77079

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl

InChI

InChI=1S/C18H18ClIN2OS/c1-2-3-4-12-5-8-14(9-6-12)21-18(24)22-17(23)15-11-13(20)7-10-16(15)19/h5-11H,2-4H2,1H3,(H2,21,22,23,24)