N-[(6-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[(6-methyl-2-thiophen-2-yl-quinolin-3-yl)methyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-[[6-methyl-2-(2-thienyl)-3-quinolyl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[(6-methyl-2-thiophen-2-yl-3-quinolinyl)methyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-[(6-methyl-2-thiophen-2-ylquinolin-3-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-[3-(2-ketopyrrolidino)propyl]-N-[[6-methyl-2-(2-thienyl)-3-quinolyl]methyl]-4-pyrazol-1-yl-benzamide Formula: C32H31N5O2S MolecularWeight: 549.68584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C3=CC=CS3)CN(CCCN4CCCC4=O)C(=O)C5=CC=C(C=C5)N6C=CC=N6

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C3=CC=CS3)CN(CCCN4CCCC4=O)C(=O)C5=CC=C(C=C5)N6C=CC=N6

InChI

InChI=1S/C32H31N5O2S/c1-23-8-13-28-25(20-23)21-26(31(34-28)29-6-3-19-40-29)22-36(17-5-16-35-15-2-7-30(35)38)32(39)24-9-11-27(12-10-24)37-18-4-14-33-37/h3-4,6,8-14,18-21H,2,5,7,15-17,22H2,1H3