quinazolin-4-yl carbamimidothioate

Systemtic Name: quinazolin-4-yl carbamimidothioate Openeye Name: 2-quinazolin-4-ylisothiourea CAS Name: carbamimidothioic acid 4-quinazolinyl ester IUPAC Name: quinazolin-4-yl carbamimidothioate Traditional Name: 2-quinazolin-4-ylisothiourea Formula: C9H8N4S MolecularWeight: 204.25162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SC(=N)N

InChI

InChI=1S/C9H8N4S/c10-9(11)14-8-6-3-1-2-4-7(6)12-5-13-8/h1-5H,(H3,10,11)