methyl N-[(4-bromophenyl)carbonylamino]-N'-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N-[(4-bromophenyl)carbonylamino]-N'-(phenylsulfonyl)carbamimidothioate Openeye Name: 3-(benzenesulfonyl)-1-[(4-bromobenzoyl)amino]-2-methyl-isothiourea CAS Name: N'-(benzenesulfonyl)-N-[[(4-bromophenyl)-oxomethyl]amino]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(benzenesulfonyl)-N-[(4-bromobenzoyl)amino]carbamimidothioate Traditional Name: 3-besyl-1-[(4-bromobenzoyl)amino]-2-methyl-isothiourea Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=CC=C1)NNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSC(=NS(=O)(=O)C1=CC=CC=C1)NNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H14BrN3O3S2/c1-23-15(19-24(21,22)13-5-3-2-4-6-13)18-17-14(20)11-7-9-12(16)10-8-11/h2-10H,1H3,(H,17,20)(H,18,19)