1-[4-methoxy-3-[[4-[(4-methoxyphenyl)methylamino]quinazolin-2-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[[4-[(4-methoxyphenyl)methylamino]quinazolin-2-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[[4-[(4-methoxyphenyl)methylamino]quinazolin-2-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[[4-[(4-methoxyphenyl)methylamino]-2-quinazolinyl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[[4-[(4-methoxyphenyl)methylamino]quinazolin-2-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[[4-(p-anisylamino)quinazolin-2-yl]thio]methyl]phenyl]ethanone Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H25N3O3S/c1-17(30)19-10-13-24(32-3)20(14-19)16-33-26-28-23-7-5-4-6-22(23)25(29-26)27-15-18-8-11-21(31-2)12-9-18/h4-14H,15-16H2,1-3H3,(H,27,28,29)