methyl N-phenylazanyl-N'-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N-phenylazanyl-N'-(phenylsulfonyl)carbamimidothioate Openeye Name: 1-anilino-3-(benzenesulfonyl)-2-methyl-isothiourea CAS Name: N-anilino-N'-(benzenesulfonyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-anilino-N'-(benzenesulfonyl)carbamimidothioate Traditional Name: 1-anilino-3-besyl-2-methyl-isothiourea Formula: C14H15N3O2S2 MolecularWeight: 321.4178

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NS(=O)(=O)C1=CC=CC=C1)NNC2=CC=CC=C2

Isomeric SMILES

CS/C(=N\S(=O)(=O)C1=CC=CC=C1)/NNC2=CC=CC=C2

InChI

InChI=1S/C14H15N3O2S2/c1-20-14(16-15-12-8-4-2-5-9-12)17-21(18,19)13-10-6-3-7-11-13/h2-11,15H,1H3,(H,16,17)