4-[6-nitro-4-(2-thiophen-2-ylethylamino)quinazolin-7-yl]piperazine-1-carbaldehyde

Systemtic Name: 4-[6-nitro-4-(2-thiophen-2-ylethylamino)quinazolin-7-yl]piperazine-1-carbaldehyde Openeye Name: 4-[6-nitro-4-[2-(2-thienyl)ethylamino]quinazolin-7-yl]piperazine-1-carbaldehyde CAS Name: 4-[6-nitro-4-(2-thiophen-2-ylethylamino)-7-quinazolinyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[6-nitro-4-(2-thiophen-2-ylethylamino)quinazolin-7-yl]piperazine-1-carbaldehyde Traditional Name: 4-[6-nitro-4-[2-(2-thienyl)ethylamino]quinazolin-7-yl]piperazine-1-carbaldehyde Formula: C19H20N6O3S MolecularWeight: 412.4655

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C=O)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O3S/c26-13-23-5-7-24(8-6-23)17-11-16-15(10-18(17)25(27)28)19(22-12-21-16)20-4-3-14-2-1-9-29-14/h1-2,9-13H,3-8H2,(H,20,21,22)