4-(aminocarbonylamino)-5-phenyl-pentanethioate

Systemtic Name: 4-(aminocarbonylamino)-5-phenyl-pentanethioate Openeye Name: 5-phenyl-4-ureido-pentanethioate CAS Name: 4-(carbamoylamino)-5-phenylpentanethioate IUPAC Name: 4-(carbamoylamino)-5-phenylpentanethioate Traditional Name: 5-phenyl-4-ureido-thiovalerate Formula: C12H15N2O2S- MolecularWeight: 251.3247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCC(=S)[O-])NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(CCC(=S)[O-])NC(=O)N

InChI

InChI=1S/C12H16N2O2S/c13-12(16)14-10(6-7-11(15)17)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,15,17)(H3,13,14,16)/p-1