2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)propanamide

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(1-piperidyl)phenyl]propanamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(4-piperidinophenyl)propionamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C25H28N4O2S/c1-3-15-29-24(31)21-9-5-6-10-22(21)27-25(29)32-18(2)23(30)26-19-11-13-20(14-12-19)28-16-7-4-8-17-28/h3,5-6,9-14,18H,1,4,7-8,15-17H2,2H3,(H,26,30)