N-[(3S)-1-[(4-ethynylphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine

Systemtic Name: N-[(3S)-1-[(4-ethynylphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine Openeye Name: N-[(3S)-1-[(4-ethynylphenyl)methyl]-3-piperidyl]-1H-indazol-5-amine CAS Name: N-[(3S)-1-[(4-ethynylphenyl)methyl]-3-piperidinyl]-1H-indazol-5-amine IUPAC Name: N-[(3S)-1-[(4-ethynylphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine Traditional Name: [(3S)-1-(4-ethynylbenzyl)-3-piperidyl]-(1H-indazol-5-yl)amine Formula: C21H22N4 MolecularWeight: 330.42618

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)CN2CCCC(C2)NC3=CC4=C(C=C3)NN=C4

Isomeric SMILES

C#CC1=CC=C(C=C1)CN2CCC[C@@H](C2)NC3=CC4=C(C=C3)NN=C4

InChI

InChI=1S/C21H22N4/c1-2-16-5-7-17(8-6-16)14-25-11-3-4-20(15-25)23-19-9-10-21-18(12-19)13-22-24-21/h1,5-10,12-13,20,23H,3-4,11,14-15H2,(H,22,24)/t20-/m0/s1