N-[4-[(3-chloranyl-4-methyl-phenyl)carbamothioylamino]phenyl]-3-methoxy-benzamide

Systemtic Name: N-[4-[(3-chloranyl-4-methyl-phenyl)carbamothioylamino]phenyl]-3-methoxy-benzamide Openeye Name: N-[4-[(3-chloro-4-methyl-phenyl)carbamothioylamino]phenyl]-3-methoxy-benzamide CAS Name: N-[4-[[(3-chloro-4-methylanilino)-sulfanylidenemethyl]amino]phenyl]-3-methoxybenzamide IUPAC Name: N-[4-[(3-chloro-4-methylphenyl)carbamothioylamino]phenyl]-3-methoxybenzamide Traditional Name: N-[4-[(3-chloro-4-methyl-phenyl)thiocarbamoylamino]phenyl]-3-methoxy-benzamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OC)Cl

InChI

InChI=1S/C22H20ClN3O2S/c1-14-6-7-18(13-20(14)23)26-22(29)25-17-10-8-16(9-11-17)24-21(27)15-4-3-5-19(12-15)28-2/h3-13H,1-2H3,(H,24,27)(H2,25,26,29)