2-(6-azanylidene-9-ethyl-purin-1-yl)ethyl thiocyanate

Systemtic Name: 2-(6-azanylidene-9-ethyl-purin-1-yl)ethyl thiocyanate Openeye Name: 2-(9-ethyl-6-imino-purin-1-yl)ethyl thiocyanate CAS Name: thiocyanic acid 2-(9-ethyl-6-imino-1-purinyl)ethyl ester IUPAC Name: 2-(9-ethyl-6-iminopurin-1-yl)ethyl thiocyanate Traditional Name: thiocyanic acid 2-(9-ethyl-6-imino-purin-1-yl)ethyl ester Formula: C10H12N6S MolecularWeight: 248.30748

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=CN(C2=N)CCSC#N

Isomeric SMILES

CCN1C=NC2=C1N=CN(C2=N)CCSC#N

InChI

InChI=1S/C10H12N6S/c1-2-15-6-13-8-9(12)16(3-4-17-5-11)7-14-10(8)15/h6-7,12H,2-4H2,1H3