methyl N-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]carbamimidothioate

Systemtic Name: methyl N-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]carbamimidothioate Openeye Name: 2-methyl-1-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]isothiourea CAS Name: N-[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]carbamimidothioic acid methyl ester IUPAC Name: methyl N-[3-(2-sulfanylethyl)-1,3-benzothiazol-2-ylidene]carbamimidothioate Traditional Name: 1-[3-(2-mercaptoethyl)-1,3-benzothiazol-2-ylidene]-2-methyl-isothiourea Formula: C11H13N3S3 MolecularWeight: 283.43602

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=N)N=C1N(C2=CC=CC=C2S1)CCS

Isomeric SMILES

CSC(=N)N=C1N(C2=CC=CC=C2S1)CCS

InChI

InChI=1S/C11H13N3S3/c1-16-10(12)13-11-14(6-7-15)8-4-2-3-5-9(8)17-11/h2-5,12,15H,6-7H2,1H3