2-(4,8-dimethylquinazolin-2-yl)-1-[1-(2-oxidanyl-4-oxidanylidene-pyran-3-yl)ethenyl]guanidine

Systemtic Name: 2-(4,8-dimethylquinazolin-2-yl)-1-[1-(2-oxidanyl-4-oxidanylidene-pyran-3-yl)ethenyl]guanidine Openeye Name: 2-(4,8-dimethylquinazolin-2-yl)-1-[1-(2-hydroxy-4-oxo-pyran-3-yl)vinyl]guanidine CAS Name: 2-(4,8-dimethyl-2-quinazolinyl)-1-[1-(2-hydroxy-4-oxo-3-pyranyl)ethenyl]guanidine IUPAC Name: 2-(4,8-dimethylquinazolin-2-yl)-1-[1-(2-hydroxy-4-oxopyran-3-yl)ethenyl]guanidine Traditional Name: 2-(4,8-dimethylquinazolin-2-yl)-1-[1-(2-hydroxy-4-keto-pyran-3-yl)vinyl]guanidine Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2C)N=C(N)NC(=C)C3=C(OC=CC3=O)O

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2C)N=C(N)NC(=C)C3=C(OC=CC3=O)O

InChI

InChI=1S/C18H17N5O3/c1-9-5-4-6-12-10(2)21-18(22-15(9)12)23-17(19)20-11(3)14-13(24)7-8-26-16(14)25/h4-8,25H,3H2,1-2H3,(H3,19,20,21,22,23)