[(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] carbamimidothioate

Systemtic Name: [(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] carbamimidothioate Openeye Name: 2-[(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl]isothiourea CAS Name: carbamimidothioic acid [(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] ester IUPAC Name: [(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] carbamimidothioate Traditional Name: 2-[(Z)-cyano-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)methyl]isothiourea Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCNC2=C(C#N)SC(=N)N)OC

Isomeric SMILES

COC1=C(C=C\2C(=C1)CCN/C2=C(/C#N)\SC(=N)N)OC

InChI

InChI=1S/C14H16N4O2S/c1-19-10-5-8-3-4-18-13(9(8)6-11(10)20-2)12(7-15)21-14(16)17/h5-6,18H,3-4H2,1-2H3,(H3,16,17)/b13-12-