2-[4-[(5-bromanyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]ethanamide

Systemtic Name: 2-[4-[(5-bromanyl-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]ethanamide Openeye Name: 2-[4-[(5-bromo-2,4-dimethoxy-phenyl)carbamothioylamino]phenyl]acetamide CAS Name: 2-[4-[[(5-bromo-2,4-dimethoxyanilino)-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: 2-[4-[(5-bromo-2,4-dimethoxyphenyl)carbamothioylamino]phenyl]acetamide Traditional Name: 2-[4-[(5-bromo-2,4-dimethoxy-phenyl)thiocarbamoylamino]phenyl]acetamide Formula: C17H18BrN3O3S MolecularWeight: 424.31212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)CC(=O)N)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=CC=C(C=C2)CC(=O)N)Br)OC

InChI

InChI=1S/C17H18BrN3O3S/c1-23-14-9-15(24-2)13(8-12(14)18)21-17(25)20-11-5-3-10(4-6-11)7-16(19)22/h3-6,8-9H,7H2,1-2H3,(H2,19,22)(H2,20,21,25)