4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbothioamide Openeye Name: 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbothioamide CAS Name: 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carbothioamide Traditional Name: 4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbothioamide Formula: C15H20N6O2S MolecularWeight: 348.4233

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=S)N)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=S)N)N)OC

InChI

InChI=1S/C15H20N6O2S/c1-22-11-7-9-10(8-12(11)23-2)18-15(19-13(9)16)21-5-3-20(4-6-21)14(17)24/h7-8H,3-6H2,1-2H3,(H2,17,24)(H2,16,18,19)