N-(3-fluorophenyl)-2-[2-[[6-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-1,3-thiazol-5-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[2-[[6-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-1,3-thiazol-5-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[2-[[6-[3-[4-(hydroxymethyl)-1-piperidyl]propoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]thiazol-5-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[2-[[6-[3-[4-(hydroxymethyl)-1-piperidinyl]propoxy]-4-pyrrolo[2,1-f][1,2,4]triazinyl]amino]-5-thiazolyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[2-[[6-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-1,3-thiazol-5-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[2-[[6-[3-(4-methylolpiperidino)propoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]thiazol-5-yl]acetamide Formula: C26H30FN7O3S MolecularWeight: 539.624903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)CCCOC2=CN3C(=C2)C(=NC=N3)NC4=NC=C(S4)CC(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

C1CN(CCC1CO)CCCOC2=CN3C(=C2)C(=NC=N3)NC4=NC=C(S4)CC(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C26H30FN7O3S/c27-19-3-1-4-20(11-19)31-24(36)13-22-14-28-26(38-22)32-25-23-12-21(15-34(23)30-17-29-25)37-10-2-7-33-8-5-18(16-35)6-9-33/h1,3-4,11-12,14-15,17-18,35H,2,5-10,13,16H2,(H,31,36)(H,28,29,30,32)