6-bromanyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-ethylsulfanyl-quinazoline

Systemtic Name: 6-bromanyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-ethylsulfanyl-quinazoline Openeye Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-ethylsulfanyl-quinazoline CAS Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-(ethylthio)quinazoline IUPAC Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-ethylsulfanylquinazoline Traditional Name: 6-bromo-2-[4-(diethoxyphosphorylmethyl)phenyl]-4-(ethylthio)quinazoline Formula: C21H24BrN2O3PS MolecularWeight: 495.369621

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=N2)SCC)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=N2)SCC)OCC

InChI

InChI=1S/C21H24BrN2O3PS/c1-4-26-28(25,27-5-2)14-15-7-9-16(10-8-15)20-23-19-12-11-17(22)13-18(19)21(24-20)29-6-3/h7-13H,4-6,14H2,1-3H3