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

Systemtic Name: 2-(3-imidazol-1-ylpropyl)-1-[4-[(5-methyl-2-oxidanylidene-1,3-dihydroimidazol-4-yl)carbonyl]phenyl]guanidine Openeye Name: 2-(3-imidazol-1-ylpropyl)-1-[4-(5-methyl-2-oxo-1,3-dihydroimidazole-4-carbonyl)phenyl]guanidine CAS Name: 2-[3-(1-imidazolyl)propyl]-1-[4-[(5-methyl-2-oxo-1,3-dihydroimidazol-4-yl)-oxomethyl]phenyl]guanidine IUPAC Name: 2-(3-imidazol-1-ylpropyl)-1-[4-(5-methyl-2-oxo-1,3-dihydroimidazole-4-carbonyl)phenyl]guanidine Traditional Name: 2-(3-imidazol-1-ylpropyl)-1-[4-(2-keto-5-methyl-4-imidazoline-4-carbonyl)phenyl]guanidine Formula: C18H21N7O2 MolecularWeight: 367.40504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)N1)C(=O)C2=CC=C(C=C2)NC(=NCCCN3C=CN=C3)N

Isomeric SMILES

CC1=C(NC(=O)N1)C(=O)C2=CC=C(C=C2)NC(=NCCCN3C=CN=C3)N

InChI

InChI=1S/C18H21N7O2/c1-12-15(24-18(27)22-12)16(26)13-3-5-14(6-4-13)23-17(19)21-7-2-9-25-10-8-20-11-25/h3-6,8,10-11H,2,7,9H2,1H3,(H3,19,21,23)(H2,22,24,27)