1-(1,3-benzothiazol-2-yl)-6-fluoranyl-3-(4-methylpiperazin-1-yl)carbonyl-7-(2-pyrrolidin-1-ylethylamino)-1,8-naphthyridin-4-one

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-6-fluoranyl-3-(4-methylpiperazin-1-yl)carbonyl-7-(2-pyrrolidin-1-ylethylamino)-1,8-naphthyridin-4-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-6-fluoro-3-(4-methylpiperazine-1-carbonyl)-7-(2-pyrrolidin-1-ylethylamino)-1,8-naphthyridin-4-one CAS Name: 1-(1,3-benzothiazol-2-yl)-6-fluoro-3-[(4-methyl-1-piperazinyl)-oxomethyl]-7-[2-(1-pyrrolidinyl)ethylamino]-1,8-naphthyridin-4-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-6-fluoro-3-(4-methylpiperazine-1-carbonyl)-7-(2-pyrrolidin-1-ylethylamino)-1,8-naphthyridin-4-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-6-fluoro-3-(4-methylpiperazine-1-carbonyl)-7-(2-pyrrolidinoethylamino)-1,8-naphthyridin-4-one Formula: C27H30FN7O2S MolecularWeight: 535.636203

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CN(C3=NC(=C(C=C3C2=O)F)NCCN4CCCC4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CN(C3=NC(=C(C=C3C2=O)F)NCCN4CCCC4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C27H30FN7O2S/c1-32-12-14-34(15-13-32)26(37)19-17-35(27-30-21-6-2-3-7-22(21)38-27)25-18(23(19)36)16-20(28)24(31-25)29-8-11-33-9-4-5-10-33/h2-3,6-7,16-17H,4-5,8-15H2,1H3,(H,29,31)