6-iodanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-olate

Systemtic Name: 6-iodanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-quinazolin-4-olate Openeye Name: 6-iodo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-olate CAS Name: 6-iodo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-quinazolinolate IUPAC Name: 6-iodo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylquinazolin-4-olate Traditional Name: 6-iodo-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-4-olate Formula: C15H15IN3O2S- MolecularWeight: 428.26797

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=N2)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=N2)[O-]

InChI

InChI=1S/C15H16IN3O2S/c16-10-4-5-12-11(8-10)14(21)18-15(17-12)22-9-13(20)19-6-2-1-3-7-19/h4-5,8H,1-3,6-7,9H2,(H,17,18,21)/p-1