7-(3-azanylpyrrolidin-1-yl)-3-[(1-ethylimidazol-2-yl)methyl]-1-(1,3-thiazol-2-yl)quinolin-4-one

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-3-[(1-ethylimidazol-2-yl)methyl]-1-(1,3-thiazol-2-yl)quinolin-4-one Openeye Name: 7-(3-aminopyrrolidin-1-yl)-3-[(1-ethylimidazol-2-yl)methyl]-1-thiazol-2-yl-quinolin-4-one CAS Name: 7-(3-amino-1-pyrrolidinyl)-3-[(1-ethyl-2-imidazolyl)methyl]-1-(2-thiazolyl)-4-quinolinone IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-3-[(1-ethylimidazol-2-yl)methyl]-1-(1,3-thiazol-2-yl)quinolin-4-one Traditional Name: 7-(3-aminopyrrolidino)-3-[(1-ethylimidazol-2-yl)methyl]-1-thiazol-2-yl-4-quinolone Formula: C22H24N6OS MolecularWeight: 420.53056

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1CC2=CN(C3=C(C2=O)C=CC(=C3)N4CCC(C4)N)C5=NC=CS5

Isomeric SMILES

CCN1C=CN=C1CC2=CN(C3=C(C2=O)C=CC(=C3)N4CCC(C4)N)C5=NC=CS5

InChI

InChI=1S/C22H24N6OS/c1-2-26-9-6-24-20(26)11-15-13-28(22-25-7-10-30-22)19-12-17(3-4-18(19)21(15)29)27-8-5-16(23)14-27/h3-4,6-7,9-10,12-13,16H,2,5,8,11,14,23H2,1H3