(2S)-2-[2-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-4-methylsulfanyl-N-propan-2-yl-butanamide

Systemtic Name: (2S)-2-[2-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-4-methylsulfanyl-N-propan-2-yl-butanamide Openeye Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)acetyl]amino]-N-isopropyl-4-methylsulfanyl-butanamide CAS Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-4-(methylthio)-N-propan-2-ylbutanamide IUPAC Name: (2S)-2-[[2-(6,7-dimethoxy-4-oxoquinazolin-3-yl)acetyl]amino]-4-methylsulfanyl-N-propan-2-ylbutanamide Traditional Name: (2S)-N-isopropyl-2-[[2-(4-keto-6,7-dimethoxy-quinazolin-3-yl)acetyl]amino]-4-(methylthio)butyramide Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(CCSC)NC(=O)CN1C=NC2=CC(=C(C=C2C1=O)OC)OC

Isomeric SMILES

CC(C)NC(=O)[C@H](CCSC)NC(=O)CN1C=NC2=CC(=C(C=C2C1=O)OC)OC

InChI

InChI=1S/C20H28N4O5S/c1-12(2)22-19(26)14(6-7-30-5)23-18(25)10-24-11-21-15-9-17(29-4)16(28-3)8-13(15)20(24)27/h8-9,11-12,14H,6-7,10H2,1-5H3,(H,22,26)(H,23,25)/t14-/m0/s1