2-bromanyl-N-[4-methylsulfanyl-1-[(6-morpholin-4-ylpyridin-3-yl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-[(6-morpholin-4-ylpyridin-3-yl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[3-methylsulfanyl-1-[(6-morpholino-3-pyridyl)carbamoyl]propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-[[6-(4-morpholinyl)-3-pyridinyl]amino]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-[(6-morpholin-4-ylpyridin-3-yl)amino]-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[3-(methylthio)-1-[(6-morpholino-3-pyridyl)carbamoyl]propyl]benzamide Formula: C21H25BrN4O3S MolecularWeight: 493.4172

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCOCC2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCOCC2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H25BrN4O3S/c1-30-13-8-18(25-20(27)16-4-2-3-5-17(16)22)21(28)24-15-6-7-19(23-14-15)26-9-11-29-12-10-26/h2-7,14,18H,8-13H2,1H3,(H,24,28)(H,25,27)