N-[(3-bromophenyl)methylideneamino]-2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(3-bromophenyl)methylideneamino]-2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(3-bromophenyl)methyleneamino]-2-(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(3-bromophenyl)methylideneamino]-2-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[(3-bromophenyl)methylideneamino]-2-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[(3-bromobenzylidene)amino]-2-[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]acetamide Formula: C18H20BrN5O2S MolecularWeight: 450.3527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC(=CC=C2)Br)N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC(=CC=C2)Br)N3CCOCC3

InChI

InChI=1S/C18H20BrN5O2S/c1-13-9-16(24-5-7-26-8-6-24)22-18(21-13)27-12-17(25)23-20-11-14-3-2-4-15(19)10-14/h2-4,9-11H,5-8,12H2,1H3,(H,23,25)