N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-(2,5-dimethylpyrazol-3-yl)carbonyl-4-prop-2-enoxy-piperidine-2-carboxamide

Systemtic Name: N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-(2,5-dimethylpyrazol-3-yl)carbonyl-4-prop-2-enoxy-piperidine-2-carboxamide Openeye Name: 4-allyloxy-N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-1-(2,5-dimethylpyrazole-3-carbonyl)piperidine-2-carboxamide CAS Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-[(2,5-dimethyl-3-pyrazolyl)-oxomethyl]-4-prop-2-enoxy-2-piperidinecarboxamide IUPAC Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-(2,5-dimethylpyrazole-3-carbonyl)-4-prop-2-enoxypiperidine-2-carboxamide Traditional Name: 4-allyloxy-N-[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-1-(2,5-dimethylpyrazole-3-carbonyl)pipecolinamide Formula: C26H32N6O4 MolecularWeight: 492.57008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N2CCC(CC2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)OCC=C)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N2CCC(CC2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)OCC=C)C

InChI

InChI=1S/C26H32N6O4/c1-4-11-36-18-9-10-32(26(35)23-12-16(2)30-31(23)3)22(14-18)25(34)29-21(24(27)33)13-17-15-28-20-8-6-5-7-19(17)20/h4-8,12,15,18,21-22,28H,1,9-11,13-14H2,2-3H3,(H2,27,33)(H,29,34)