2-methoxy-N-[4-methylsulfanyl-1-[(5-morpholin-4-ylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-[(5-morpholin-4-ylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[(5-morpholino-2-pyridyl)carbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-[[5-(4-morpholinyl)-2-pyridinyl]amino]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-[(5-morpholin-4-ylpyridin-2-yl)amino]-1-oxobutan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[(5-morpholino-2-pyridyl)carbamoyl]propyl]benzamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NC2=NC=C(C=C2)N3CCOCC3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NC2=NC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C22H28N4O4S/c1-29-19-6-4-3-5-17(19)21(27)24-18(9-14-31-2)22(28)25-20-8-7-16(15-23-20)26-10-12-30-13-11-26/h3-8,15,18H,9-14H2,1-2H3,(H,24,27)(H,23,25,28)