ethyl 2-[4-[(2Z)-2-(4-azanyl-2-oxidanylidene-quinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(2Z)-2-(4-azanyl-2-oxidanylidene-quinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(2Z)-2-(4-amino-2-oxo-3-quinolylidene)-1,3-dihydrobenzimidazol-5-yl]piperazin-1-yl]acetate CAS Name: 2-[4-[(2Z)-2-(4-amino-2-oxo-3-quinolinylidene)-1,3-dihydrobenzimidazol-5-yl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2Z)-2-(4-amino-2-oxoquinolin-3-ylidene)-1,3-dihydrobenzimidazol-5-yl]piperazin-1-yl]acetate Traditional Name: 2-[4-[(2Z)-2-(4-amino-2-keto-3-quinolylidene)-1,3-dihydrobenzimidazol-5-yl]piperazino]acetic acid ethyl ester Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)C2=CC3=C(C=C2)NC(=C4C(=C5C=CC=CC5=NC4=O)N)N3

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)C2=CC3=C(C=C2)N/C(=C/4\C(=C5C=CC=CC5=NC4=O)N)/N3

InChI

InChI=1S/C24H26N6O3/c1-2-33-20(31)14-29-9-11-30(12-10-29)15-7-8-18-19(13-15)27-23(26-18)21-22(25)16-5-3-4-6-17(16)28-24(21)32/h3-8,13,26-27H,2,9-12,14,25H2,1H3/b23-21-