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

Systemtic Name: 2-(3-azanylpiperidin-1-yl)-3-but-2-ynyl-N-methyl-N-(3-methylisoquinolin-1-yl)imidazole-4-carboxamide Openeye Name: 2-(3-amino-1-piperidyl)-3-but-2-ynyl-N-methyl-N-(3-methyl-1-isoquinolyl)imidazole-4-carboxamide CAS Name: 2-(3-amino-1-piperidinyl)-3-but-2-ynyl-N-methyl-N-(3-methyl-1-isoquinolinyl)-4-imidazolecarboxamide IUPAC Name: 2-(3-aminopiperidin-1-yl)-3-but-2-ynyl-N-methyl-N-(3-methylisoquinolin-1-yl)imidazole-4-carboxamide Traditional Name: 2-(3-aminopiperidino)-3-but-2-ynyl-N-methyl-N-(3-methyl-1-isoquinolyl)imidazole-4-carboxamide Formula: C24H28N6O MolecularWeight: 416.51872

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=CN=C1N2CCCC(C2)N)C(=O)N(C)C3=NC(=CC4=CC=CC=C43)C

Isomeric SMILES

CC#CCN1C(=CN=C1N2CCCC(C2)N)C(=O)N(C)C3=NC(=CC4=CC=CC=C43)C

InChI

InChI=1S/C24H28N6O/c1-4-5-13-30-21(15-26-24(30)29-12-8-10-19(25)16-29)23(31)28(3)22-20-11-7-6-9-18(20)14-17(2)27-22/h6-7,9,11,14-15,19H,8,10,12-13,16,25H2,1-3H3