2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)thio]acetic acid IUPAC Name: 2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-methyl-7,8,9,10-tetrahydrobenzo[h]quinazolin-2-yl)thio]acetic acid Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC3=C2CCCC3)SCC(=O)O

Isomeric SMILES

CC1=NC(=NC2=C1C=CC3=C2CCCC3)SCC(=O)O

InChI

InChI=1S/C15H16N2O2S/c1-9-11-7-6-10-4-2-3-5-12(10)14(11)17-15(16-9)20-8-13(18)19/h6-7H,2-5,8H2,1H3,(H,18,19)