1-(2-azanyl-5-propylsulfanyl-phenyl)-3-propyl-urea

Systemtic Name: 1-(2-azanyl-5-propylsulfanyl-phenyl)-3-propyl-urea Openeye Name: 1-(2-amino-5-propylsulfanyl-phenyl)-3-propyl-urea CAS Name: 1-[2-amino-5-(propylthio)phenyl]-3-propylurea IUPAC Name: 1-(2-amino-5-propylsulfanylphenyl)-3-propylurea Traditional Name: 1-[2-amino-5-(propylthio)phenyl]-3-propyl-urea Formula: C13H21N3OS MolecularWeight: 267.39034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C=CC(=C1)SCCC)N

Isomeric SMILES

CCCNC(=O)NC1=C(C=CC(=C1)SCCC)N

InChI

InChI=1S/C13H21N3OS/c1-3-7-15-13(17)16-12-9-10(18-8-4-2)5-6-11(12)14/h5-6,9H,3-4,7-8,14H2,1-2H3,(H2,15,16,17)