N-[4-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[[4-(ethylamino)-2-quinazolinyl]thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[[4-(ethylamino)quinazolin-2-yl]thio]acetyl]phenyl]propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC

InChI

InChI=1S/C21H22N4O2S/c1-3-19(27)23-15-11-9-14(10-12-15)18(26)13-28-21-24-17-8-6-5-7-16(17)20(25-21)22-4-2/h5-12H,3-4,13H2,1-2H3,(H,23,27)(H,22,24,25)