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

Systemtic Name: 4-chloranyl-N-[(3-phenylmethoxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(3-benzyloxyphenyl)carbamothioyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[(3-phenylmethoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(3-phenylmethoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(3-benzoxyphenyl)thiocarbamoyl]-4-chloro-benzamide Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN2O2S/c22-17-11-9-16(10-12-17)20(25)24-21(27)23-18-7-4-8-19(13-18)26-14-15-5-2-1-3-6-15/h1-13H,14H2,(H2,23,24,25,27)