2-(3-azanylpiperidin-1-yl)-3-but-2-ynyl-N-phenethyl-imidazole-4-carboxamide

Systemtic Name: 2-(3-azanylpiperidin-1-yl)-3-but-2-ynyl-N-phenethyl-imidazole-4-carboxamide Openeye Name: 2-(3-amino-1-piperidyl)-3-but-2-ynyl-N-phenethyl-imidazole-4-carboxamide CAS Name: 2-(3-amino-1-piperidinyl)-3-but-2-ynyl-N-phenethyl-4-imidazolecarboxamide IUPAC Name: 2-(3-aminopiperidin-1-yl)-3-but-2-ynyl-N-phenethylimidazole-4-carboxamide Traditional Name: 2-(3-aminopiperidino)-3-but-2-ynyl-N-phenethyl-imidazole-4-carboxamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=CN=C1N2CCCC(C2)N)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC#CCN1C(=CN=C1N2CCCC(C2)N)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O/c1-2-3-14-26-19(15-24-21(26)25-13-7-10-18(22)16-25)20(27)23-12-11-17-8-5-4-6-9-17/h4-6,8-9,15,18H,7,10-14,16,22H2,1H3,(H,23,27)