[1-[(3S)-1-(1H-indol-2-ylmethyl)piperidin-3-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-[(3S)-1-(1H-indol-2-ylmethyl)piperidin-3-yl]-1,2,3-triazol-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-[(3S)-1-(1H-indol-2-ylmethyl)-3-piperidyl]triazol-4-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-[(3S)-1-(1H-indol-2-ylmethyl)-3-piperidinyl]-4-triazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-[(3S)-1-(1H-indol-2-ylmethyl)piperidin-3-yl]triazol-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-[(3S)-1-(1H-indol-2-ylmethyl)-3-piperidyl]triazol-4-yl]-pyrrolidino-methanone Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CN(N=N2)C3CCCN(C3)CC4=CC5=CC=CC=C5N4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CN(N=N2)[C@H]3CCCN(C3)CC4=CC5=CC=CC=C5N4

InChI

InChI=1S/C21H26N6O/c28-21(26-10-3-4-11-26)20-15-27(24-23-20)18-7-5-9-25(14-18)13-17-12-16-6-1-2-8-19(16)22-17/h1-2,6,8,12,15,18,22H,3-5,7,9-11,13-14H2/t18-/m0/s1