(2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-cyclohexyl-N-ethyl-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-cyclohexyl-N-ethyl-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C23H33N3O2S MolecularWeight: 415.59202

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C23H33N3O2S/c1-5-25(18-11-7-6-8-12-18)21(27)17(4)29-23-24-20-14-10-9-13-19(20)22(28)26(23)15-16(2)3/h9-10,13-14,16-18H,5-8,11-12,15H2,1-4H3/t17-/m0/s1