1-(2,6-diethylphenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea Openeye Name: 1-(2,6-diethylphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea IUPAC Name: 1-(2,6-diethylphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea Traditional Name: 1-(2,6-diethylphenyl)-3-[3-(2-ketopyrrolidino)propyl]thiourea Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NCCCN2CCCC2=O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NCCCN2CCCC2=O

InChI

InChI=1S/C18H27N3OS/c1-3-14-8-5-9-15(4-2)17(14)20-18(23)19-11-7-13-21-12-6-10-16(21)22/h5,8-9H,3-4,6-7,10-13H2,1-2H3,(H2,19,20,23)