(2R)-2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide

Systemtic Name: (2R)-2-[3-[(2S)-butan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Openeye Name: (2R)-N-(2-ethoxyphenyl)-2-[3-[(1S)-1-methylpropyl]-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-2-[[3-[(2S)-butan-2-yl]-4-oxo-2-quinazolinyl]thio]-N-(2-ethoxyphenyl)propanamide IUPAC Name: (2R)-2-[3-[(2S)-butan-2-yl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-ethoxyphenyl)propanamide Traditional Name: (2R)-2-[[4-keto-3-[(1S)-1-methylpropyl]quinazolin-2-yl]thio]-N-o-phenetyl-propionamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C23H27N3O3S/c1-5-15(3)26-22(28)17-11-7-8-12-18(17)25-23(26)30-16(4)21(27)24-19-13-9-10-14-20(19)29-6-2/h7-16H,5-6H2,1-4H3,(H,24,27)/t15-,16+/m0/s1