2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]acetamide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC4CC4

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC4CC4

InChI

InChI=1S/C22H22N4OS2/c1-2-13-28-19-10-6-5-9-18(19)24-20(27)14-29-22-25-17-8-4-3-7-16(17)21(26-22)23-15-11-12-15/h2-10,15H,1,11-14H2,(H,24,27)(H,23,25,26)