1-[5-[3-(carbamothioylamino)phenoxy]pentyl]-3-(4-phenoxyphenyl)thiourea

Systemtic Name: 1-[5-[3-(carbamothioylamino)phenoxy]pentyl]-3-(4-phenoxyphenyl)thiourea Openeye Name: 1-[5-[3-(carbamothioylamino)phenoxy]pentyl]-3-(4-phenoxyphenyl)thiourea CAS Name: 1-[5-[3-(carbamothioylamino)phenoxy]pentyl]-3-(4-phenoxyphenyl)thiourea IUPAC Name: 1-[5-[3-(carbamothioylamino)phenoxy]pentyl]-3-(4-phenoxyphenyl)thiourea Traditional Name: 1-(4-phenoxyphenyl)-3-[5-(3-thioureidophenoxy)pentyl]thiourea Formula: C25H28N4O2S2 MolecularWeight: 480.64542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NCCCCCOC3=CC=CC(=C3)NC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NCCCCCOC3=CC=CC(=C3)NC(=S)N

InChI

InChI=1S/C25H28N4O2S2/c26-24(32)28-20-8-7-11-23(18-20)30-17-6-2-5-16-27-25(33)29-19-12-14-22(15-13-19)31-21-9-3-1-4-10-21/h1,3-4,7-15,18H,2,5-6,16-17H2,(H3,26,28,32)(H2,27,29,33)