1-[3-[5-[bis(azanyl)methylideneamino]-1,2,4-thiadiazol-3-yl]phenyl]-3-cyano-2-methyl-guanidine

Systemtic Name: 1-[3-[5-[bis(azanyl)methylideneamino]-1,2,4-thiadiazol-3-yl]phenyl]-3-cyano-2-methyl-guanidine Openeye Name: 1-cyano-3-[3-(5-guanidino-1,2,4-thiadiazol-3-yl)phenyl]-2-methyl-guanidine CAS Name: 1-cyano-3-[3-[5-(diaminomethylideneamino)-1,2,4-thiadiazol-3-yl]phenyl]-2-methylguanidine IUPAC Name: 1-cyano-3-[3-[5-(diaminomethylideneamino)-1,2,4-thiadiazol-3-yl]phenyl]-2-methylguanidine Traditional Name: 1-cyano-3-[3-(5-guanidino-1,2,4-thiadiazol-3-yl)phenyl]-2-methyl-guanidine Formula: C12H13N9S MolecularWeight: 315.35692

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NC#N)NC1=CC=CC(=C1)C2=NSC(=N2)N=C(N)N

Isomeric SMILES

CN=C(NC#N)NC1=CC=CC(=C1)C2=NSC(=N2)N=C(N)N

InChI

InChI=1S/C12H13N9S/c1-16-11(17-6-13)18-8-4-2-3-7(5-8)9-19-12(22-21-9)20-10(14)15/h2-5H,1H3,(H2,16,17,18)(H4,14,15,19,20,21)