2-(3-azanylpiperidin-1-yl)-5-bromanyl-3-but-2-ynyl-N-(naphthalen-1-ylmethyl)imidazole-4-carboxamide

Systemtic Name: 2-(3-azanylpiperidin-1-yl)-5-bromanyl-3-but-2-ynyl-N-(naphthalen-1-ylmethyl)imidazole-4-carboxamide Openeye Name: 2-(3-amino-1-piperidyl)-5-bromo-3-but-2-ynyl-N-(1-naphthylmethyl)imidazole-4-carboxamide CAS Name: 2-(3-amino-1-piperidinyl)-5-bromo-3-but-2-ynyl-N-(1-naphthalenylmethyl)-4-imidazolecarboxamide IUPAC Name: 2-(3-aminopiperidin-1-yl)-5-bromo-3-but-2-ynyl-N-(naphthalen-1-ylmethyl)imidazole-4-carboxamide Traditional Name: 2-(3-aminopiperidino)-5-bromo-3-but-2-ynyl-N-(1-naphthylmethyl)imidazole-4-carboxamide Formula: C24H26BrN5O MolecularWeight: 480.40014

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=C(N=C1N2CCCC(C2)N)Br)C(=O)NCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC#CCN1C(=C(N=C1N2CCCC(C2)N)Br)C(=O)NCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H26BrN5O/c1-2-3-14-30-21(22(25)28-24(30)29-13-7-11-19(26)16-29)23(31)27-15-18-10-6-9-17-8-4-5-12-20(17)18/h4-6,8-10,12,19H,7,11,13-16,26H2,1H3,(H,27,31)