2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]-3-[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]quinazoline-4-thione

Systemtic Name: 2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]-3-[[(2S)-2-oxidanyl-2-phenyl-ethyl]amino]quinazoline-4-thione Openeye Name: 2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]-3-[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]quinazoline-4-thione CAS Name: 2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-3-[[(2S)-2-hydroxy-2-phenylethyl]amino]-4-quinazolinethione IUPAC Name: 2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-3-[[(2S)-2-hydroxy-2-phenylethyl]amino]quinazoline-4-thione Traditional Name: 2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]-3-[[(2S)-2-hydroxy-2-phenyl-ethyl]amino]quinazoline-4-thione Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=NC2=CC=CC=C2C(=S)N1NCC(C3=CC=CC=C3)O)O

Isomeric SMILES

CC(C)(C)[C@@H](C1=NC2=CC=CC=C2C(=S)N1NC[C@H](C3=CC=CC=C3)O)O

InChI

InChI=1S/C21H25N3O2S/c1-21(2,3)18(26)19-23-16-12-8-7-11-15(16)20(27)24(19)22-13-17(25)14-9-5-4-6-10-14/h4-12,17-18,22,25-26H,13H2,1-3H3/t17-,18-/m1/s1