4-[4-[3-(2-methoxyphenyl)pyrrolidin-1-yl]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one

Systemtic Name: 4-[4-[3-(2-methoxyphenyl)pyrrolidin-1-yl]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one Openeye Name: 4-[4-[3-(2-methoxyphenyl)pyrrolidin-1-yl]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one CAS Name: 4-[4-[3-(2-methoxyphenyl)-1-pyrrolidinyl]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one IUPAC Name: 4-[4-[3-(2-methoxyphenyl)pyrrolidin-1-yl]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one Traditional Name: 4-[4-[3-(2-methoxyphenyl)pyrrolidino]phenyl]-2-[2-(2-phenoxyethylamino)ethyl]-1,2,4-triazol-3-one Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(C2)C3=CC=C(C=C3)N4C=NN(C4=O)CCNCCOC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2CCN(C2)C3=CC=C(C=C3)N4C=NN(C4=O)CCNCCOC5=CC=CC=C5

InChI

InChI=1S/C29H33N5O3/c1-36-28-10-6-5-9-27(28)23-15-18-32(21-23)24-11-13-25(14-12-24)33-22-31-34(29(33)35)19-16-30-17-20-37-26-7-3-2-4-8-26/h2-14,22-23,30H,15-21H2,1H3