N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butanamide

Systemtic Name: N-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butanamide Openeye Name: 4-(4-benzylpiperazin-1-yl)-N-[4-methyl-2-(1-piperidyl)-6-quinolyl]-4-oxo-butanamide CAS Name: N-[4-methyl-2-(1-piperidinyl)-6-quinolinyl]-4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butanamide IUPAC Name: 4-(4-benzylpiperazin-1-yl)-N-(4-methyl-2-piperidin-1-ylquinolin-6-yl)-4-oxobutanamide Traditional Name: 4-(4-benzylpiperazino)-4-keto-N-(4-methyl-2-piperidino-6-quinolyl)butyramide Formula: C30H37N5O2 MolecularWeight: 499.64708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C30H37N5O2/c1-23-20-28(34-14-6-3-7-15-34)32-27-11-10-25(21-26(23)27)31-29(36)12-13-30(37)35-18-16-33(17-19-35)22-24-8-4-2-5-9-24/h2,4-5,8-11,20-21H,3,6-7,12-19,22H2,1H3,(H,31,36)