6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoate

Systemtic Name: 6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoate Openeye Name: 6-[(2-thioxo-1H-quinazolin-4-yl)amino]hexanoate CAS Name: 6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoate IUPAC Name: 6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoate Traditional Name: 6-[(2-thioxo-1H-quinazolin-4-yl)amino]hexanoate Formula: C14H16N3O2S- MolecularWeight: 290.36074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=S)N2)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=S)N2)NCCCCCC(=O)[O-]

InChI

InChI=1S/C14H17N3O2S/c18-12(19)8-2-1-5-9-15-13-10-6-3-4-7-11(10)16-14(20)17-13/h3-4,6-7H,1-2,5,8-9H2,(H,18,19)(H2,15,16,17,20)/p-1