N-butan-2-yl-2-[3-[(4-methoxyphenyl)methyl]-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butan-2-yl-2-[3-[(4-methoxyphenyl)methyl]-6-morpholin-4-yl-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[3-[(4-methoxyphenyl)methyl]-6-morpholino-4-oxo-quinazolin-2-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[3-[(4-methoxyphenyl)methyl]-6-(4-morpholinyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-butan-2-yl-2-[3-[(4-methoxyphenyl)methyl]-6-morpholin-4-yl-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[(4-keto-6-morpholino-3-p-anisyl-quinazolin-2-yl)thio]-N-sec-butyl-acetamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CC4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=C(C=C(C=C2)N3CCOCC3)C(=O)N1CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H32N4O4S/c1-4-18(2)27-24(31)17-35-26-28-23-10-7-20(29-11-13-34-14-12-29)15-22(23)25(32)30(26)16-19-5-8-21(33-3)9-6-19/h5-10,15,18H,4,11-14,16-17H2,1-3H3,(H,27,31)