1-[(E)-7H-purin-6-ylmethylideneamino]thiourea

Systemtic Name: 1-[(E)-7H-purin-6-ylmethylideneamino]thiourea Openeye Name: [(E)-7H-purin-6-ylmethyleneamino]thiourea CAS Name: [(E)-7H-purin-6-ylmethylideneamino]thiourea IUPAC Name: [(E)-7H-purin-6-ylmethylideneamino]thiourea Traditional Name: [(E)-7H-purin-6-ylmethyleneamino]thiourea Formula: C7H7N7S MolecularWeight: 221.24238

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=NC=NC(=C2N1)C=NNC(=S)N

Isomeric SMILES

C1=NC2=NC=NC(=C2N1)/C=N/NC(=S)N

InChI

InChI=1S/C7H7N7S/c8-7(15)14-13-1-4-5-6(11-2-9-4)12-3-10-5/h1-3H,(H3,8,14,15)(H,9,10,11,12)/b13-1+