1-[[2-(2-carbamothioylhydrazinyl)-6,7-dimethoxy-quinazolin-4-yl]amino]thiourea

Systemtic Name: 1-[[2-(2-carbamothioylhydrazinyl)-6,7-dimethoxy-quinazolin-4-yl]amino]thiourea Openeye Name: [[2-(2-carbamothioylhydrazino)-6,7-dimethoxy-quinazolin-4-yl]amino]thiourea CAS Name: [[2-(carbamothioylhydrazo)-6,7-dimethoxy-4-quinazolinyl]amino]thiourea IUPAC Name: [[2-(2-carbamothioylhydrazinyl)-6,7-dimethoxyquinazolin-4-yl]amino]thiourea Traditional Name: [[6,7-dimethoxy-2-(N'-thiocarbamoylhydrazino)quinazolin-4-yl]amino]thiourea Formula: C12H16N8O2S2 MolecularWeight: 368.43784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NNC(=S)N)NNC(=S)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NNC(=S)N)NNC(=S)N)OC

InChI

InChI=1S/C12H16N8O2S2/c1-21-7-3-5-6(4-8(7)22-2)15-12(20-19-11(14)24)16-9(5)17-18-10(13)23/h3-4H,1-2H3,(H3,13,18,23)(H3,14,19,24)(H2,15,16,17,20)