N-(4-bromophenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(4-bromophenyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C21H21BrN4O2S MolecularWeight: 473.38604

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O2S/c22-15-5-7-16(8-6-15)23-20(27)14-29-21-17-3-1-2-4-18(17)24-19(25-21)13-26-9-11-28-12-10-26/h1-8H,9-14H2,(H,23,27)