2-(1-thiophen-2-ylpyrimido[1,6-a]indol-5-yl)ethanoic acid

Systemtic Name: 2-(1-thiophen-2-ylpyrimido[1,6-a]indol-5-yl)ethanoic acid Openeye Name: 2-[1-(2-thienyl)pyrimido[1,6-a]indol-5-yl]acetic acid CAS Name: 2-(1-thiophen-2-yl-5-pyrimido[1,6-a]indolyl)acetic acid IUPAC Name: 2-(1-thiophen-2-ylpyrimido[1,6-a]indol-5-yl)acetic acid Traditional Name: 2-[1-(2-thienyl)pyrimid[1,6-a]indol-5-yl]acetic acid Formula: C17H12N2O2S MolecularWeight: 308.35438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3N2C(=NC=C3)C4=CC=CS4)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3N2C(=NC=C3)C4=CC=CS4)CC(=O)O

InChI

InChI=1S/C17H12N2O2S/c20-16(21)10-12-11-4-1-2-5-13(11)19-14(12)7-8-18-17(19)15-6-3-9-22-15/h1-9H,10H2,(H,20,21)