1-cyano-3-[4-[(5-methyl-2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonyl]phenyl]-2-(3-phenylpropyl)guanidine

Systemtic Name: 1-cyano-3-[4-[(5-methyl-2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonyl]phenyl]-2-(3-phenylpropyl)guanidine Openeye Name: 1-cyano-3-[4-(5-methyl-2-oxo-1,3-dihydroimidazole-4-carbonyl)phenyl]-2-(3-phenylpropyl)guanidine CAS Name: 1-cyano-3-[4-[(5-methyl-2-oxo-1,3-dihydroimidazol-4-yl)-oxomethyl]phenyl]-2-(3-phenylpropyl)guanidine IUPAC Name: 1-cyano-3-[4-(5-methyl-2-oxo-1,3-dihydroimidazole-4-carbonyl)phenyl]-2-(3-phenylpropyl)guanidine Traditional Name: 1-cyano-3-[4-(2-keto-5-methyl-4-imidazoline-4-carbonyl)phenyl]-2-(3-phenylpropyl)guanidine Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)N1)C(=O)C2=CC=C(C=C2)NC(=NCCCC3=CC=CC=C3)NC#N

Isomeric SMILES

CC1=C(NC(=O)N1)C(=O)C2=CC=C(C=C2)NC(=NCCCC3=CC=CC=C3)NC#N

InChI

InChI=1S/C22H22N6O2/c1-15-19(28-22(30)26-15)20(29)17-9-11-18(12-10-17)27-21(25-14-23)24-13-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-12H,5,8,13H2,1H3,(H2,24,25,27)(H2,26,28,30)