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

Systemtic Name: 1-methyl-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]thiourea Openeye Name: 1-methyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]thiourea CAS Name: 1-methyl-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-methyl-3-[4-(2-oxopyrrolidin-1-yl)phenyl]thiourea Traditional Name: 1-[4-(2-ketopyrrolidino)phenyl]-3-methyl-thiourea Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3OS/c1-13-12(17)14-9-4-6-10(7-5-9)15-8-2-3-11(15)16/h4-7H,2-3,8H2,1H3,(H2,13,14,17)