1-(4-butylphenyl)-3-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[oxo-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[3-[(2-ketopyrrolidino)methyl]benzoyl]amino]thiourea Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)CN3CCCC3=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)CN3CCCC3=O

InChI

InChI=1S/C23H28N4O2S/c1-2-3-6-17-10-12-20(13-11-17)24-23(30)26-25-22(29)19-8-4-7-18(15-19)16-27-14-5-9-21(27)28/h4,7-8,10-13,15H,2-3,5-6,9,14,16H2,1H3,(H,25,29)(H2,24,26,30)