1-[2-azanyl-3-(1-methylimidazol-4-yl)propanoyl]-N-(3,3-dimethyl-4-oxidanylidene-azetidin-2-yl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[2-azanyl-3-(1-methylimidazol-4-yl)propanoyl]-N-(3,3-dimethyl-4-oxidanylidene-azetidin-2-yl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: 1-[2-amino-3-(1-methylimidazol-4-yl)propanoyl]-N-(3,3-dimethyl-4-oxo-azetidine-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: 1-[2-amino-3-(1-methyl-4-imidazolyl)-1-oxopropyl]-N-[(3,3-dimethyl-4-oxo-2-azetidinyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[2-amino-3-(1-methylimidazol-4-yl)propanoyl]-N-(3,3-dimethyl-4-oxoazetidine-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: 1-[2-amino-3-(1-methylimidazol-4-yl)propanoyl]-N-(4-keto-3,3-dimethyl-azetidine-2-carbonyl)pyrrolidine-2-carboxamide Formula: C18H26N6O4 MolecularWeight: 390.43684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NC1=O)C(=O)NC(=O)C2CCCN2C(=O)C(CC3=CN(C=N3)C)N)C

Isomeric SMILES

CC1(C(NC1=O)C(=O)NC(=O)C2CCCN2C(=O)C(CC3=CN(C=N3)C)N)C

InChI

InChI=1S/C18H26N6O4/c1-18(2)13(21-17(18)28)15(26)22-14(25)12-5-4-6-24(12)16(27)11(19)7-10-8-23(3)9-20-10/h8-9,11-13H,4-7,19H2,1-3H3,(H,21,28)(H,22,25,26)