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

Systemtic Name: (2S)-N-cyclopentyl-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-cyclopentyl-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-cyclopentyl-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-cyclopentyl-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-cyclopentyl-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C19H25N3O3S/c1-13(17(24)20-14-7-2-3-8-14)26-19-21-16-10-5-4-9-15(16)18(25)22(19)11-6-12-23/h4-5,9-10,13-14,23H,2-3,6-8,11-12H2,1H3,(H,20,24)/t13-/m0/s1