2-[4-oxidanylidene-2-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[1-(phenylmethyl)imidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[2-[(1-benzylimidazol-2-yl)sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[[1-(phenylmethyl)-2-imidazolyl]thio]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[2-[(1-benzylimidazol-2-yl)sulfanylmethyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[2-[[(1-benzylimidazol-2-yl)thio]methyl]-4-keto-quinazolin-3-yl]acetamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=C2SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=C2SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C21H19N5O2S/c22-18(27)13-26-19(24-17-9-5-4-8-16(17)20(26)28)14-29-21-23-10-11-25(21)12-15-6-2-1-3-7-15/h1-11H,12-14H2,(H2,22,27)