1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-guanidine

Systemtic Name: 1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-guanidine Openeye Name: 1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-guanidine CAS Name: 1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenylguanidine IUPAC Name: 1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenylguanidine Traditional Name: 1-cyano-2-(6-methoxy-1,3-benzothiazol-2-yl)-1-phenyl-guanidine Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N=C(N)N(C#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)/N=C(/N)\N(C#N)C3=CC=CC=C3

InChI

InChI=1S/C16H13N5OS/c1-22-12-7-8-13-14(9-12)23-16(19-13)20-15(18)21(10-17)11-5-3-2-4-6-11/h2-9H,1H3,(H2,18,19,20)