N-[1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]pyrrolidin-3-yl]-4-(phenylcarbonyl)benzamide

Systemtic Name: N-[1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]pyrrolidin-3-yl]-4-(phenylcarbonyl)benzamide Openeye Name: 4-benzoyl-N-[1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]pyrrolidin-3-yl]benzamide CAS Name: 4-benzoyl-N-[1-[2-[[[(2-methyl-4-quinolinyl)amino]-oxomethyl]amino]ethyl]-3-pyrrolidinyl]benzamide IUPAC Name: 4-benzoyl-N-[1-[2-[(2-methylquinolin-4-yl)carbamoylamino]ethyl]pyrrolidin-3-yl]benzamide Traditional Name: 4-benzoyl-N-[1-[2-[(2-methyl-4-quinolyl)carbamoylamino]ethyl]pyrrolidin-3-yl]benzamide Formula: C31H31N5O3 MolecularWeight: 521.60954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)NC(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H31N5O3/c1-21-19-28(26-9-5-6-10-27(26)33-21)35-31(39)32-16-18-36-17-15-25(20-36)34-30(38)24-13-11-23(12-14-24)29(37)22-7-3-2-4-8-22/h2-14,19,25H,15-18,20H2,1H3,(H,34,38)(H2,32,33,35,39)