N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N-methyl-2-morpholino-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3-fluoroanilino)-2-keto-ethyl]-N-methyl-2-morpholino-5-piperidinosulfonyl-benzamide Formula: C25H31FN4O5S MolecularWeight: 518.600843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4

InChI

InChI=1S/C25H31FN4O5S/c1-28(18-24(31)27-20-7-5-6-19(26)16-20)25(32)22-17-21(36(33,34)30-10-3-2-4-11-30)8-9-23(22)29-12-14-35-15-13-29/h5-9,16-17H,2-4,10-15,18H2,1H3,(H,27,31)