methyl N'-(2-azanyl-1,3-benzothiazol-6-yl)carbamimidothioate

Systemtic Name: methyl N'-(2-azanyl-1,3-benzothiazol-6-yl)carbamimidothioate Openeye Name: 3-(2-amino-1,3-benzothiazol-6-yl)-2-methyl-isothiourea CAS Name: N'-(2-amino-1,3-benzothiazol-6-yl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-(2-amino-1,3-benzothiazol-6-yl)carbamimidothioate Traditional Name: 3-(2-amino-1,3-benzothiazol-6-yl)-2-methyl-isothiourea Formula: C9H10N4S2 MolecularWeight: 238.3325

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC2=C(C=C1)N=C(S2)N)N

Isomeric SMILES

CSC(=NC1=CC2=C(C=C1)N=C(S2)N)N

InChI

InChI=1S/C9H10N4S2/c1-14-8(10)12-5-2-3-6-7(4-5)15-9(11)13-6/h2-4H,1H3,(H2,10,12)(H2,11,13)