4-azanyl-8-pentyl-N-prop-2-ynyl-cinnoline-3-carboxamide

Systemtic Name: 4-azanyl-8-pentyl-N-prop-2-ynyl-cinnoline-3-carboxamide Openeye Name: 4-amino-8-pentyl-N-prop-2-ynyl-cinnoline-3-carboxamide CAS Name: 4-amino-8-pentyl-N-prop-2-ynyl-3-cinnolinecarboxamide IUPAC Name: 4-amino-8-pentyl-N-prop-2-ynylcinnoline-3-carboxamide Traditional Name: 4-amino-8-amyl-N-propargyl-cinnoline-3-carboxamide Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC2=C1N=NC(=C2N)C(=O)NCC#C

Isomeric SMILES

CCCCCC1=CC=CC2=C1N=NC(=C2N)C(=O)NCC#C

InChI

InChI=1S/C17H20N4O/c1-3-5-6-8-12-9-7-10-13-14(18)16(21-20-15(12)13)17(22)19-11-4-2/h2,7,9-10H,3,5-6,8,11H2,1H3,(H2,18,20)(H,19,22)