[(3R,4R)-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-[[(1R)-1-phenylethyl]amino]piperidin-3-yl]methanol

Systemtic Name: [(3R,4R)-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-[[(1R)-1-phenylethyl]amino]piperidin-3-yl]methanol Openeye Name: [(3R,4R)-1-[[4-(3-methoxyanilino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-[[(1R)-1-phenylethyl]amino]-3-piperidyl]methanol CAS Name: [(3R,4R)-1-[[4-(3-methoxyanilino)-5-pyrrolo[2,1-f][1,2,4]triazinyl]methyl]-4-[[(1R)-1-phenylethyl]amino]-3-piperidinyl]methanol IUPAC Name: [(3R,4R)-1-[[4-(3-methoxyanilino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-[[(1R)-1-phenylethyl]amino]piperidin-3-yl]methanol Traditional Name: [(3R,4R)-1-[[4-(m-anisidino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-[[(1R)-1-phenylethyl]amino]-3-piperidyl]methanol Formula: C28H34N6O2 MolecularWeight: 486.60856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2CCN(CC2CO)CC3=C4C(=NC=NN4C=C3)NC5=CC(=CC=C5)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N[C@@H]2CCN(C[C@H]2CO)CC3=C4C(=NC=NN4C=C3)NC5=CC(=CC=C5)OC

InChI

InChI=1S/C28H34N6O2/c1-20(21-7-4-3-5-8-21)31-26-12-13-33(17-23(26)18-35)16-22-11-14-34-27(22)28(29-19-30-34)32-24-9-6-10-25(15-24)36-2/h3-11,14-15,19-20,23,26,31,35H,12-13,16-18H2,1-2H3,(H,29,30,32)/t20-,23+,26-/m1/s1