1-[2-(diethylamino)ethanoyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride

Systemtic Name: 1-[2-(diethylamino)ethanoyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride Openeye Name: 1-[2-(diethylamino)acetyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride CAS Name: 1-[2-(diethylamino)-1-oxoethyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride IUPAC Name: 1-[2-(diethylamino)acetyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride Traditional Name: 1-[2-(diethylamino)acetyl]-2-methyl-3-phenyl-2H-quinazolin-4-one hydrate hydrochloride Formula: C21H28ClN3O3 MolecularWeight: 405.91832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)N1C(N(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C.O.Cl

Isomeric SMILES

CCN(CC)CC(=O)N1C(N(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C.O.Cl

InChI

InChI=1S/C21H25N3O2.ClH.H2O/c1-4-22(5-2)15-20(25)24-16(3)23(17-11-7-6-8-12-17)21(26)18-13-9-10-14-19(18)24;;/h6-14,16H,4-5,15H2,1-3H3;1H;1H2