(2S)-2-[[(2S)-4-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[(2S)-4-methyl-2-(4-oxidanylidenequinazolin-3-yl)pentanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[(2S)-4-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2S)-4-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)pentyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[(2S)-4-methyl-2-(4-oxoquinazolin-3-yl)pentanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(2S)-2-(4-ketoquinazolin-3-yl)-4-methyl-pentanoyl]amino]-4-(methylthio)butyrate Formula: C19H24N3O4S- MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCSC)C(=O)[O-])N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)[O-])N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C19H25N3O4S/c1-12(2)10-16(17(23)21-15(19(25)26)8-9-27-3)22-11-20-14-7-5-4-6-13(14)18(22)24/h4-7,11-12,15-16H,8-10H2,1-3H3,(H,21,23)(H,25,26)/p-1/t15-,16-/m0/s1