N-(4-bromophenyl)-2-[5-ethyl-6-methyl-4-(4-prop-2-enylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[5-ethyl-6-methyl-4-(4-prop-2-enylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[4-(4-allylpiperazin-1-yl)-5-ethyl-6-methyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-bromophenyl)acetamide CAS Name: N-(4-bromophenyl)-2-[[5-ethyl-6-methyl-4-(4-prop-2-enyl-1-piperazinyl)-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[5-ethyl-6-methyl-4-(4-prop-2-enylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-(4-allylpiperazino)-5-ethyl-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]-N-(4-bromophenyl)acetamide Formula: C24H28BrN5OS2 MolecularWeight: 546.54602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)CC=C)SCC(=O)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CCC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)CC=C)SCC(=O)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C24H28BrN5OS2/c1-4-10-29-11-13-30(14-12-29)22-21-19(5-2)16(3)33-23(21)28-24(27-22)32-15-20(31)26-18-8-6-17(25)7-9-18/h4,6-9H,1,5,10-15H2,2-3H3,(H,26,31)