methyl 2-[4-[[(2-bromophenyl)carbonylamino]carbamothioylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[[(2-bromophenyl)carbonylamino]carbamothioylamino]phenyl]ethanoate Openeye Name: methyl 2-[4-[[(2-bromobenzoyl)amino]carbamothioylamino]phenyl]acetate CAS Name: 2-[4-[[[[(2-bromophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[(2-bromobenzoyl)amino]carbamothioylamino]phenyl]acetate Traditional Name: 2-[4-[[(2-bromobenzoyl)amino]thiocarbamoylamino]phenyl]acetic acid methyl ester Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=CC=C2Br

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C17H16BrN3O3S/c1-24-15(22)10-11-6-8-12(9-7-11)19-17(25)21-20-16(23)13-4-2-3-5-14(13)18/h2-9H,10H2,1H3,(H,20,23)(H2,19,21,25)