2-[2-[[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: 2-[2-[[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: 2-[2-[[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[2-[[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]methyl]-4-oxo-3-quinazolinyl]acetamide IUPAC Name: 2-[2-[[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[4-keto-2-[[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]thio]methyl]quinazolin-3-yl]acetamide Formula: C26H21N5O4S MolecularWeight: 499.54104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4CC(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4CC(=O)N

InChI

InChI=1S/C26H21N5O4S/c1-35-17-8-6-7-16(13-17)31-25(34)19-10-3-5-12-21(19)29-26(31)36-15-23-28-20-11-4-2-9-18(20)24(33)30(23)14-22(27)32/h2-13H,14-15H2,1H3,(H2,27,32)