3-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[(5-chloranyl-2-methoxy-phenyl)carbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[(5-chloro-2-methoxy-phenyl)carbamothioylamino]benzamide CAS Name: 3-[[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[(5-chloro-2-methoxyphenyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-3-[(5-chloro-2-methoxy-phenyl)thiocarbamoylamino]benzamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O2S/c1-28-20-11-10-17(23)13-19(20)26-22(29)25-18-9-5-8-16(12-18)21(27)24-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,24,27)(H2,25,26,29)