(2S)-N-ethyl-2-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]propanamide

Systemtic Name: (2S)-N-ethyl-2-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]propanamide Openeye Name: (2S)-N-ethyl-2-[[2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]propanamide CAS Name: (2S)-N-ethyl-2-[[2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-ethyl-2-[[2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]propanamide Traditional Name: (2S)-N-ethyl-2-[[2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]propionamide Formula: C20H28N4O3S MolecularWeight: 404.52632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC(C)C

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC(C)C

InChI

InChI=1S/C20H28N4O3S/c1-5-21-18(26)14(4)22-17(25)12-28-20-23-16-9-7-6-8-15(16)19(27)24(20)11-10-13(2)3/h6-9,13-14H,5,10-12H2,1-4H3,(H,21,26)(H,22,25)/t14-/m0/s1