ethyl (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]-2-phenyl-ethanoate

Systemtic Name: ethyl (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]-2-phenyl-ethanoate Openeye Name: ethyl (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]-2-phenyl-acetate CAS Name: (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]-2-phenylacetate Traditional Name: (2R)-2-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)thio]-2-phenyl-acetic acid ethyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NC3=C(CCCC3)C(=N2)C

Isomeric SMILES

CCOC(=O)[C@@H](C1=CC=CC=C1)SC2=NC3=C(CCCC3)C(=N2)C

InChI

InChI=1S/C19H22N2O2S/c1-3-23-18(22)17(14-9-5-4-6-10-14)24-19-20-13(2)15-11-7-8-12-16(15)21-19/h4-6,9-10,17H,3,7-8,11-12H2,1-2H3/t17-/m1/s1