(3S,4S)-1-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol

Systemtic Name: (3S,4S)-1-[(3-methyl-1-prop-2-enyl-pyrazol-4-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Openeye Name: (3S,4S)-1-[(1-allyl-3-methyl-pyrazol-4-yl)methyl]-4-[4-(2-pyridyl)piperazin-1-yl]pyrrolidin-3-ol CAS Name: (3S,4S)-1-[(3-methyl-1-prop-2-enyl-4-pyrazolyl)methyl]-4-[4-(2-pyridinyl)-1-piperazinyl]-3-pyrrolidinol IUPAC Name: (3S,4S)-1-[(3-methyl-1-prop-2-enylpyrazol-4-yl)methyl]-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol Traditional Name: (3S,4S)-1-[(1-allyl-3-methyl-pyrazol-4-yl)methyl]-4-[4-(2-pyridyl)piperazino]pyrrolidin-3-ol Formula: C21H30N6O MolecularWeight: 382.5025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CN2CC(C(C2)O)N3CCN(CC3)C4=CC=CC=N4)CC=C

Isomeric SMILES

CC1=NN(C=C1CN2C[C@@H]([C@H](C2)O)N3CCN(CC3)C4=CC=CC=N4)CC=C

InChI

InChI=1S/C21H30N6O/c1-3-8-27-14-18(17(2)23-27)13-24-15-19(20(28)16-24)25-9-11-26(12-10-25)21-6-4-5-7-22-21/h3-7,14,19-20,28H,1,8-13,15-16H2,2H3/t19-,20-/m0/s1