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1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea

1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name:1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea
Openeye Name:1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea
CAS Name:1-[(2S)-2-ethylhexyl]-3-[3-(1-pyrrolidinylsulfonyl)phenyl]thiourea
IUPAC Name:1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea
Traditional Name:1-[(2S)-2-ethylhexyl]-3-(3-pyrrolidinosulfonylphenyl)thiourea
Formula: C19H31N3O2S2
MolecularWeight: 397.59834
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2


Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2


InChI

InChI=1S/C19H31N3O2S2/c1-3-5-9-16(4-2)15-20-19(25)21-17-10-8-11-18(14-17)26(23,24)22-12-6-7-13-22/h8,10-11,14,16H,3-7,9,12-13,15H2,1-2H3,(H2,20,21,25)/t16-/m0/s1


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