1-(3-methylbutyl)-7-[[4-[4-(3-oxidanylpropyl)piperidin-1-yl]phenyl]amino]-1,6-naphthyridin-2-one

Systemtic Name: 1-(3-methylbutyl)-7-[[4-[4-(3-oxidanylpropyl)piperidin-1-yl]phenyl]amino]-1,6-naphthyridin-2-one Openeye Name: 7-[4-[4-(3-hydroxypropyl)-1-piperidyl]anilino]-1-isopentyl-1,6-naphthyridin-2-one CAS Name: 7-[4-[4-(3-hydroxypropyl)-1-piperidinyl]anilino]-1-(3-methylbutyl)-1,6-naphthyridin-2-one IUPAC Name: 7-[4-[4-(3-hydroxypropyl)piperidin-1-yl]anilino]-1-(3-methylbutyl)-1,6-naphthyridin-2-one Traditional Name: 7-[4-[4-(3-hydroxypropyl)piperidino]anilino]-1-isoamyl-1,6-naphthyridin-2-one Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C=CC2=CN=C(C=C21)NC3=CC=C(C=C3)N4CCC(CC4)CCCO

Isomeric SMILES

CC(C)CCN1C(=O)C=CC2=CN=C(C=C21)NC3=CC=C(C=C3)N4CCC(CC4)CCCO

InChI

InChI=1S/C27H36N4O2/c1-20(2)11-16-31-25-18-26(28-19-22(25)5-10-27(31)33)29-23-6-8-24(9-7-23)30-14-12-21(13-15-30)4-3-17-32/h5-10,18-21,32H,3-4,11-17H2,1-2H3,(H,28,29)