N-(cyclohexylcarbamoyl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(cyclohexylcarbamoyl)-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C(=O)NC(=O)NC1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C21H28N4O4S/c1-14(18(27)24-20(29)22-15-8-3-2-4-9-15)30-21-23-17-11-6-5-10-16(17)19(28)25(21)12-7-13-26/h5-6,10-11,14-15,26H,2-4,7-9,12-13H2,1H3,(H2,22,24,27,29)