N-[2-methyl-5-[4-(quinolin-8-ylmethyl)piperazin-1-yl]carbonyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[2-methyl-5-[4-(quinolin-8-ylmethyl)piperazin-1-yl]carbonyl-phenyl]furan-2-carboxamide Openeye Name: N-[2-methyl-5-[4-(8-quinolylmethyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: N-[2-methyl-5-[oxo-[4-(8-quinolinylmethyl)-1-piperazinyl]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[2-methyl-5-[4-(quinolin-8-ylmethyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[2-methyl-5-[4-(8-quinolylmethyl)piperazine-1-carbonyl]phenyl]-2-furamide Formula: C27H26N4O3 MolecularWeight: 454.52034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C27H26N4O3/c1-19-9-10-21(17-23(19)29-26(32)24-8-4-16-34-24)27(33)31-14-12-30(13-15-31)18-22-6-2-5-20-7-3-11-28-25(20)22/h2-11,16-17H,12-15,18H2,1H3,(H,29,32)