5-(4-azanylbutyl)-3-phenyl-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 5-(4-azanylbutyl)-3-phenyl-2-sulfanylidene-imidazolidin-4-one Openeye Name: 5-(4-aminobutyl)-3-phenyl-2-thioxo-imidazolidin-4-one CAS Name: 5-(4-aminobutyl)-3-phenyl-2-sulfanylidene-4-imidazolidinone IUPAC Name: 5-(4-aminobutyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one Traditional Name: 5-(4-aminobutyl)-3-phenyl-2-thioxo-4-imidazolidinone Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(NC2=S)CCCCN

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(NC2=S)CCCCN

InChI

InChI=1S/C13H17N3OS/c14-9-5-4-8-11-12(17)16(13(18)15-11)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9,14H2,(H,15,18)