N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-8-carboxamide

Systemtic Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-8-carboxamide Openeye Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-8-carboxamide CAS Name: N-[(2,5-dimethyl-3-pyrazolyl)methyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-8-quinolinecarboxamide IUPAC Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-8-carboxamide Traditional Name: N-[(2,5-dimethylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazino)propyl]quinoline-8-carboxamide Formula: C24H32N6O MolecularWeight: 420.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)CN(CCCN2CCN(CC2)C)C(=O)C3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=NN(C(=C1)CN(CCCN2CCN(CC2)C)C(=O)C3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C24H32N6O/c1-19-17-21(28(3)26-19)18-30(12-6-11-29-15-13-27(2)14-16-29)24(31)22-9-4-7-20-8-5-10-25-23(20)22/h4-5,7-10,17H,6,11-16,18H2,1-3H3