methyl N-benzamido-N'-(4-bromophenyl)sulfonyl-carbamimidothioate

Systemtic Name: methyl N-benzamido-N'-(4-bromophenyl)sulfonyl-carbamimidothioate Openeye Name: 1-benzamido-3-(4-bromophenyl)sulfonyl-2-methyl-isothiourea CAS Name: N-benzamido-N'-(4-bromophenyl)sulfonylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-benzamido-N'-(4-bromophenyl)sulfonylcarbamimidothioate Traditional Name: 1-benzamido-3-brosyl-2-methyl-isothiourea Formula: C15H14BrN3O3S2 MolecularWeight: 428.32396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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