N-[4-[2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]acetyl]phenyl]propionamide Formula: C25H27N3O3S MolecularWeight: 449.56518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

InChI

InChI=1S/C25H27N3O3S/c1-2-23(30)26-18-14-12-17(13-15-18)22(29)16-32-25-27-21-11-7-6-10-20(21)24(31)28(25)19-8-4-3-5-9-19/h6-7,10-15,19H,2-5,8-9,16H2,1H3,(H,26,30)