N-cyclohexyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cyclohexyl-propanamide CAS Name: N-cyclohexyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-cyclohexyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-cyclohexyl-propionamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NC1CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C20H25N3O2S/c1-3-13-23-19(25)16-11-7-8-12-17(16)22-20(23)26-14(2)18(24)21-15-9-5-4-6-10-15/h3,7-8,11-12,14-15H,1,4-6,9-10,13H2,2H3,(H,21,24)