methyl N-(4-aminophenyl)sulfonyl-N'-(furan-2-ylmethyl)carbamimidothioate

Systemtic Name: methyl N-(4-aminophenyl)sulfonyl-N'-(furan-2-ylmethyl)carbamimidothioate Openeye Name: 1-(4-aminophenyl)sulfonyl-3-(2-furylmethyl)-2-methyl-isothiourea CAS Name: N-(4-aminophenyl)sulfonyl-N'-(2-furanylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-aminophenyl)sulfonyl-N'-(furan-2-ylmethyl)carbamimidothioate Traditional Name: 3-(2-furfuryl)-2-methyl-1-sulfanilyl-isothiourea Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1=CC=CO1)NS(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CSC(=NCC1=CC=CO1)NS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C13H15N3O3S2/c1-20-13(15-9-11-3-2-8-19-11)16-21(17,18)12-6-4-10(14)5-7-12/h2-8H,9,14H2,1H3,(H,15,16)