[3-[(2S)-2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl] N-cyclopentylcarbamate

Systemtic Name: [3-[(2S)-2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl] N-cyclopentylcarbamate Openeye Name: [3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxo-propyl]-1H-indol-5-yl] N-cyclopentylcarbamate CAS Name: N-cyclopentylcarbamic acid [3-[(2S)-2-amino-3-[(2S)-2-cyano-1-pyrrolidinyl]-3-oxopropyl]-1H-indol-5-yl] ester IUPAC Name: [3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxopropyl]-1H-indol-5-yl] N-cyclopentylcarbamate Traditional Name: N-cyclopentylcarbamic acid [3-[(2S)-2-amino-3-[(2S)-2-cyanopyrrolidino]-3-keto-propyl]-1H-indol-5-yl] ester Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)OC2=CC3=C(C=C2)NC=C3CC(C(=O)N4CCCC4C#N)N

Isomeric SMILES

C1CCC(C1)NC(=O)OC2=CC3=C(C=C2)NC=C3C[C@@H](C(=O)N4CCC[C@H]4C#N)N

InChI

InChI=1S/C22H27N5O3/c23-12-16-6-3-9-27(16)21(28)19(24)10-14-13-25-20-8-7-17(11-18(14)20)30-22(29)26-15-4-1-2-5-15/h7-8,11,13,15-16,19,25H,1-6,9-10,24H2,(H,26,29)/t16-,19-/m0/s1