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5-(3-dimethoxyphosphorylpropylsulfanyl)-2-ethyl-1-(phenylmethyl)indole

5-(3-dimethoxyphosphorylpropylsulfanyl)-2-ethyl-1-(phenylmethyl)indole

Systemtic Name:5-(3-dimethoxyphosphorylpropylsulfanyl)-2-ethyl-1-(phenylmethyl)indole
Openeye Name:1-benzyl-5-(3-dimethoxyphosphorylpropylsulfanyl)-2-ethyl-indole
CAS Name:5-(3-dimethoxyphosphorylpropylthio)-2-ethyl-1-(phenylmethyl)indole
IUPAC Name:1-benzyl-5-(3-dimethoxyphosphorylpropylsulfanyl)-2-ethylindole
Traditional Name:1-benzyl-5-(3-dimethoxyphosphorylpropylthio)-2-ethyl-indole
Formula: C22H28NO3PS
MolecularWeight: 417.501381
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N1CC3=CC=CC=C3)C=CC(=C2)SCCCP(=O)(OC)OC


Isomeric SMILES

CCC1=CC2=C(N1CC3=CC=CC=C3)C=CC(=C2)SCCCP(=O)(OC)OC


InChI

InChI=1S/C22H28NO3PS/c1-4-20-15-19-16-21(28-14-8-13-27(24,25-2)26-3)11-12-22(19)23(20)17-18-9-6-5-7-10-18/h5-7,9-12,15-16H,4,8,13-14,17H2,1-3H3


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