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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCCC3

InChI

InChI=1S/C20H25N3O2S/c1-3-13-21-18(24)14(2)26-20-22-17-12-8-7-11-16(17)19(25)23(20)15-9-5-4-6-10-15/h3,7-8,11-12,14-15H,1,4-6,9-10,13H2,2H3,(H,21,24)/t14-/m1/s1