5-azanyl-4-(1H-benzimidazol-2-yl)-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-4-(1H-benzimidazol-2-yl)-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one Openeye Name: 5-amino-4-(1H-benzimidazol-2-yl)-1-[(1S)-1-methylhexyl]-2H-pyrrol-3-one CAS Name: 5-amino-4-(1H-benzimidazol-2-yl)-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one IUPAC Name: 5-amino-4-(1H-benzimidazol-2-yl)-1-[(2S)-heptan-2-yl]-2H-pyrrol-3-one Traditional Name: 5-amino-4-(1H-benzimidazol-2-yl)-1-[(1S)-1-methylhexyl]-2-pyrrolin-3-one Formula: C18H24N4O MolecularWeight: 312.40936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N1CC(=O)C(=C1N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCCC[C@H](C)N1CC(=O)C(=C1N)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H24N4O/c1-3-4-5-8-12(2)22-11-15(23)16(17(22)19)18-20-13-9-6-7-10-14(13)21-18/h6-7,9-10,12H,3-5,8,11,19H2,1-2H3,(H,20,21)/t12-/m0/s1