1-(4-azanyl-2-sulfanylidene-quinazolin-3-yl)cyclohexane-1-carboxylic acid

Systemtic Name: 1-(4-azanyl-2-sulfanylidene-quinazolin-3-yl)cyclohexane-1-carboxylic acid Openeye Name: 1-(4-amino-2-thioxo-quinazolin-3-yl)cyclohexanecarboxylic acid CAS Name: 1-(4-amino-2-sulfanylidene-3-quinazolinyl)-1-cyclohexanecarboxylic acid IUPAC Name: 1-(4-amino-2-sulfanylidenequinazolin-3-yl)cyclohexane-1-carboxylic acid Traditional Name: 1-(4-amino-2-thioxo-quinazolin-3-yl)cyclohexanecarboxylic acid Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)N2C(=C3C=CC=CC3=NC2=S)N

Isomeric SMILES

C1CCC(CC1)(C(=O)O)N2C(=C3C=CC=CC3=NC2=S)N

InChI

InChI=1S/C15H17N3O2S/c16-12-10-6-2-3-7-11(10)17-14(21)18(12)15(13(19)20)8-4-1-5-9-15/h2-3,6-7H,1,4-5,8-9,16H2,(H,19,20)