2-[1,3-bis(azanyl)-6-thiophen-2-yl-pyrrolo[3,2-f]quinazolin-7-yl]ethanoic acid

Systemtic Name: 2-[1,3-bis(azanyl)-6-thiophen-2-yl-pyrrolo[3,2-f]quinazolin-7-yl]ethanoic acid Openeye Name: 2-[1,3-diamino-6-(2-thienyl)pyrrolo[3,2-f]quinazolin-7-yl]acetic acid CAS Name: 2-(1,3-diamino-6-thiophen-2-yl-7-pyrrolo[3,2-f]quinazolinyl)acetic acid IUPAC Name: 2-(1,3-diamino-6-thiophen-2-ylpyrrolo[3,2-f]quinazolin-7-yl)acetic acid Traditional Name: 2-[1,3-diamino-6-(2-thienyl)pyrrolo[3,2-f]quinazolin-7-yl]acetic acid Formula: C16H13N5O2S MolecularWeight: 339.37172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC3=C(C4=C2N(C=C4)CC(=O)O)C(=NC(=N3)N)N

Isomeric SMILES

C1=CSC(=C1)C2=CC3=C(C4=C2N(C=C4)CC(=O)O)C(=NC(=N3)N)N

InChI

InChI=1S/C16H13N5O2S/c17-15-13-8-3-4-21(7-12(22)23)14(8)9(11-2-1-5-24-11)6-10(13)19-16(18)20-15/h1-6H,7H2,(H,22,23)(H4,17,18,19,20)