N-(2-methoxyphenyl)-2-[4-(prop-2-enylamino)phthalazin-1-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methoxyphenyl)-2-[4-(prop-2-enylamino)phthalazin-1-yl]sulfanyl-ethanamide Openeye Name: 2-[4-(allylamino)phthalazin-1-yl]sulfanyl-N-(2-methoxyphenyl)acetamide CAS Name: N-(2-methoxyphenyl)-2-[[4-(prop-2-enylamino)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-[4-(prop-2-enylamino)phthalazin-1-yl]sulfanylacetamide Traditional Name: 2-[[4-(allylamino)phthalazin-1-yl]thio]-N-(2-methoxyphenyl)acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CSC2=NN=C(C3=CC=CC=C32)NCC=C

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CSC2=NN=C(C3=CC=CC=C32)NCC=C

InChI

InChI=1S/C20H20N4O2S/c1-3-12-21-19-14-8-4-5-9-15(14)20(24-23-19)27-13-18(25)22-16-10-6-7-11-17(16)26-2/h3-11H,1,12-13H2,2H3,(H,21,23)(H,22,25)