1-(4-fluorophenyl)carbonyl-N-[1-[3-(2-methylpropylamino)propylamino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-[1-[3-(2-methylpropylamino)propylamino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorobenzoyl)-N-[2-[3-(isobutylamino)propylamino]-1-(2-naphthylmethyl)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-[1-[3-(2-methylpropylamino)propylamino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorobenzoyl)-N-[1-[3-(2-methylpropylamino)propylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorobenzoyl)-N-[2-[3-(isobutylamino)propylamino]-2-keto-1-(2-naphthylmethyl)ethyl]isonipecotamide Formula: C33H41FN4O3 MolecularWeight: 560.702043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCCCNC(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)CNCCCNC(=O)C(CC1=CC2=CC=CC=C2C=C1)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C33H41FN4O3/c1-23(2)22-35-16-5-17-36-32(40)30(21-24-8-9-25-6-3-4-7-28(25)20-24)37-31(39)26-14-18-38(19-15-26)33(41)27-10-12-29(34)13-11-27/h3-4,6-13,20,23,26,30,35H,5,14-19,21-22H2,1-2H3,(H,36,40)(H,37,39)