3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-oxidanylidene-N-propyl-butanamide

Systemtic Name: 3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-oxidanylidene-N-propyl-butanamide Openeye Name: 3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-oxo-N-propyl-butanamide CAS Name: 3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-oxo-N-propylbutanamide IUPAC Name: 3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-oxo-N-propylbutanamide Traditional Name: 3-(ethynylamino)-4-(1H-imidazol-5-yl)-2-keto-N-propyl-butyramide Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(=O)C(CC1=CN=CN1)NC#C

Isomeric SMILES

CCCNC(=O)C(=O)C(CC1=CN=CN1)NC#C

InChI

InChI=1S/C12H16N4O2/c1-3-5-15-12(18)11(17)10(14-4-2)6-9-7-13-8-16-9/h2,7-8,10,14H,3,5-6H2,1H3,(H,13,16)(H,15,18)