5-[3-(dimethylamino)propylamino]-2-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[3-(dimethylamino)propylamino]-2-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[3-(dimethylamino)propylamino]-2-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]oxazole-4-carbonitrile CAS Name: 5-[3-(dimethylamino)propylamino]-2-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-4-oxazolecarbonitrile IUPAC Name: 5-[3-(dimethylamino)propylamino]-2-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[3-(dimethylamino)propylamino]-2-(4-methoxy-3-piperidinosulfonyl-phenyl)oxazole-4-carbonitrile Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=C(N=C(O1)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)C#N

Isomeric SMILES

CN(C)CCCNC1=C(N=C(O1)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)C#N

InChI

InChI=1S/C21H29N5O4S/c1-25(2)11-7-10-23-21-17(15-22)24-20(30-21)16-8-9-18(29-3)19(14-16)31(27,28)26-12-5-4-6-13-26/h8-9,14,23H,4-7,10-13H2,1-3H3