[2-(cyanoamino)-1,3-thiazol-4-yl]methyl carbamimidothioate

Systemtic Name: [2-(cyanoamino)-1,3-thiazol-4-yl]methyl carbamimidothioate Openeye Name: 2-[[2-(cyanoamino)thiazol-4-yl]methyl]isothiourea CAS Name: carbamimidothioic acid [2-(cyanoamino)-4-thiazolyl]methyl ester IUPAC Name: [2-(cyanoamino)-1,3-thiazol-4-yl]methyl carbamimidothioate Traditional Name: 2-[[2-(cyanoamino)thiazol-4-yl]methyl]isothiourea Formula: C6H7N5S2 MolecularWeight: 213.28328

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)NC#N)CSC(=N)N

Isomeric SMILES

C1=C(N=C(S1)NC#N)CSC(=N)N

InChI

InChI=1S/C6H7N5S2/c7-3-10-6-11-4(2-13-6)1-12-5(8)9/h2H,1H2,(H3,8,9)(H,10,11)