1-(4-ethylphenyl)-3-[3-(2-oxidanylideneazepan-1-yl)propyl]thiourea

Systemtic Name: 1-(4-ethylphenyl)-3-[3-(2-oxidanylideneazepan-1-yl)propyl]thiourea Openeye Name: 1-(4-ethylphenyl)-3-[3-(2-oxoazepan-1-yl)propyl]thiourea CAS Name: 1-(4-ethylphenyl)-3-[3-(2-oxo-1-azepanyl)propyl]thiourea IUPAC Name: 1-(4-ethylphenyl)-3-[3-(2-oxoazepan-1-yl)propyl]thiourea Traditional Name: 1-(4-ethylphenyl)-3-[3-(2-ketoazepan-1-yl)propyl]thiourea Formula: C18H27N3OS MolecularWeight: 333.49148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NCCCN2CCCCCC2=O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NCCCN2CCCCCC2=O

InChI

InChI=1S/C18H27N3OS/c1-2-15-8-10-16(11-9-15)20-18(23)19-12-6-14-21-13-5-3-4-7-17(21)22/h8-11H,2-7,12-14H2,1H3,(H2,19,20,23)