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

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-cyclohexyl-N-ethyl-2-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-cyclohexyl-N-ethyl-2-[[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]propionamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCOC

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2CCOC

InChI

InChI=1S/C22H31N3O3S/c1-4-24(17-10-6-5-7-11-17)20(26)16(2)29-22-23-19-13-9-8-12-18(19)21(27)25(22)14-15-28-3/h8-9,12-13,16-17H,4-7,10-11,14-15H2,1-3H3/t16-/m0/s1