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

Systemtic Name: methyl 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetate CAS Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetate Traditional Name: 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid methyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=NC2=C1CCCC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CSC1=NC(=NC2=C1CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O2S/c1-21-15(20)11-22-17-13-9-5-6-10-14(13)18-16(19-17)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3