4-[[4-[(1R)-1-phenylethyl]sulfanylquinazolin-2-yl]methyl]morpholin-4-ium

Systemtic Name: 4-[[4-[(1R)-1-phenylethyl]sulfanylquinazolin-2-yl]methyl]morpholin-4-ium Openeye Name: 4-[[4-[(1R)-1-phenylethyl]sulfanylquinazolin-2-yl]methyl]morpholin-4-ium CAS Name: 4-[[4-[[(1R)-1-phenylethyl]thio]-2-quinazolinyl]methyl]morpholin-4-ium IUPAC Name: 4-[[4-[(1R)-1-phenylethyl]sulfanylquinazolin-2-yl]methyl]morpholin-4-ium Traditional Name: 4-[[4-[[(1R)-1-phenylethyl]thio]quinazolin-2-yl]methyl]morpholin-4-ium Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

C[C@H](C1=CC=CC=C1)SC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C21H23N3OS/c1-16(17-7-3-2-4-8-17)26-21-18-9-5-6-10-19(18)22-20(23-21)15-24-11-13-25-14-12-24/h2-10,16H,11-15H2,1H3/p+1/t16-/m1/s1