N-[(4-butylphenyl)carbamothioyl]-3-chloranyl-benzamide

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-3-chloranyl-benzamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-3-chloro-benzamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-3-chlorobenzamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-3-chlorobenzamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-3-chloro-benzamide Formula: C18H19ClN2OS MolecularWeight: 346.87426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2OS/c1-2-3-5-13-8-10-16(11-9-13)20-18(23)21-17(22)14-6-4-7-15(19)12-14/h4,6-12H,2-3,5H2,1H3,(H2,20,21,22,23)