(2R,3S)-2-ethyl-3-phenylmethoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfonyl]pentan-1-ol

Systemtic Name: (2R,3S)-2-ethyl-3-phenylmethoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfonyl]pentan-1-ol Openeye Name: (2R,3S)-3-benzyloxy-2-ethyl-5-(1-phenyltetrazol-5-yl)sulfonyl-pentan-1-ol CAS Name: (2R,3S)-2-ethyl-3-phenylmethoxy-5-[(1-phenyl-5-tetrazolyl)sulfonyl]-1-pentanol IUPAC Name: (2R,3S)-2-ethyl-3-phenylmethoxy-5-(1-phenyltetrazol-5-yl)sulfonylpentan-1-ol Traditional Name: (2R,3S)-3-benzoxy-2-ethyl-5-(1-phenyltetrazol-5-yl)sulfonyl-pentan-1-ol Formula: C21H26N4O4S MolecularWeight: 430.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C(CCS(=O)(=O)C1=NN=NN1C2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC[C@H](CO)[C@H](CCS(=O)(=O)C1=NN=NN1C2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-2-18(15-26)20(29-16-17-9-5-3-6-10-17)13-14-30(27,28)21-22-23-24-25(21)19-11-7-4-8-12-19/h3-12,18,20,26H,2,13-16H2,1H3/t18-,20+/m1/s1