[2-(dimethylaminomethyl)quinazolin-4-yl] carbamimidothioate

Systemtic Name: [2-(dimethylaminomethyl)quinazolin-4-yl] carbamimidothioate Openeye Name: 2-[2-(dimethylaminomethyl)quinazolin-4-yl]isothiourea CAS Name: carbamimidothioic acid [2-(dimethylaminomethyl)-4-quinazolinyl] ester IUPAC Name: [2-(dimethylaminomethyl)quinazolin-4-yl] carbamimidothioate Traditional Name: 2-[2-(dimethylaminomethyl)quinazolin-4-yl]isothiourea Formula: C12H15N5S MolecularWeight: 261.346

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=CC=CC=C2C(=N1)SC(=N)N

Isomeric SMILES

CN(C)CC1=NC2=CC=CC=C2C(=N1)SC(=N)N

InChI

InChI=1S/C12H15N5S/c1-17(2)7-10-15-9-6-4-3-5-8(9)11(16-10)18-12(13)14/h3-6H,7H2,1-2H3,(H3,13,14)