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

Systemtic Name: [(Z)-cyano(3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] carbamimidothioate Openeye Name: 2-[(Z)-cyano(3,4-dihydro-2H-isoquinolin-1-ylidene)methyl]isothiourea CAS Name: carbamimidothioic acid [(Z)-cyano(3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] ester IUPAC Name: [(Z)-cyano(3,4-dihydro-2H-isoquinolin-1-ylidene)methyl] carbamimidothioate Traditional Name: 2-[(Z)-cyano(3,4-dihydro-2H-isoquinolin-1-ylidene)methyl]isothiourea Formula: C12H12N4S MolecularWeight: 244.31548

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=C(C#N)SC(=N)N)C2=CC=CC=C21

Isomeric SMILES

C1CN/C(=C(/C#N)\SC(=N)N)/C2=CC=CC=C21

InChI

InChI=1S/C12H12N4S/c13-7-10(17-12(14)15)11-9-4-2-1-3-8(9)5-6-16-11/h1-4,16H,5-6H2,(H3,14,15)/b11-10-