1-ethyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-ethyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-ethyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-ethyl-3-[3-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-ethyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-ethyl-3-(3-pyrrolidinosulfonylphenyl)thiourea Formula: C13H19N3O2S2 MolecularWeight: 313.43886

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCNC(=S)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C13H19N3O2S2/c1-2-14-13(19)15-11-6-5-7-12(10-11)20(17,18)16-8-3-4-9-16/h5-7,10H,2-4,8-9H2,1H3,(H2,14,15,19)