2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetic acid CAS Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid IUPAC Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetic acid Traditional Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)SCC(=O)O

Isomeric SMILES

C1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)SCC(=O)O

InChI

InChI=1S/C16H16N2O2S/c19-14(20)10-21-16-12-8-4-5-9-13(12)17-15(18-16)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,19,20)