4-[(2,4-dichlorophenyl)amino]-7-[(4-ethylpiperazin-1-yl)methyl]quinoline-3-carbonitrile

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-7-[(4-ethylpiperazin-1-yl)methyl]quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloroanilino)-7-[(4-ethylpiperazin-1-yl)methyl]quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloroanilino)-7-[(4-ethyl-1-piperazinyl)methyl]-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloroanilino)-7-[(4-ethylpiperazin-1-yl)methyl]quinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloroanilino)-7-[(4-ethylpiperazino)methyl]quinoline-3-carbonitrile Formula: C23H23Cl2N5 MolecularWeight: 440.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC3=NC=C(C(=C3C=C2)NC4=C(C=C(C=C4)Cl)Cl)C#N

Isomeric SMILES

CCN1CCN(CC1)CC2=CC3=NC=C(C(=C3C=C2)NC4=C(C=C(C=C4)Cl)Cl)C#N

InChI

InChI=1S/C23H23Cl2N5/c1-2-29-7-9-30(10-8-29)15-16-3-5-19-22(11-16)27-14-17(13-26)23(19)28-21-6-4-18(24)12-20(21)25/h3-6,11-12,14H,2,7-10,15H2,1H3,(H,27,28)