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

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-3-chloranyl-4-ethoxy-benzamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-3-chloro-4-ethoxy-benzamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-3-chloro-4-ethoxybenzamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-3-chloro-4-ethoxybenzamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-3-chloro-4-ethoxy-benzamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O2S/c1-3-5-6-14-7-10-16(11-8-14)22-20(26)23-19(24)15-9-12-18(25-4-2)17(21)13-15/h7-13H,3-6H2,1-2H3,(H2,22,23,24,26)