1-[2,3-dimethyl-4-[4-(phenethylcarbamothioylamino)phenoxy]phenyl]-3-phenethyl-thiourea

Systemtic Name: 1-[2,3-dimethyl-4-[4-(phenethylcarbamothioylamino)phenoxy]phenyl]-3-phenethyl-thiourea Openeye Name: 1-[2,3-dimethyl-4-[4-(phenethylcarbamothioylamino)phenoxy]phenyl]-3-phenethyl-thiourea CAS Name: 1-[2,3-dimethyl-4-[4-[[(phenethylamino)-sulfanylidenemethyl]amino]phenoxy]phenyl]-3-phenethylthiourea IUPAC Name: 1-[2,3-dimethyl-4-[4-(phenethylcarbamothioylamino)phenoxy]phenyl]-3-phenethylthiourea Traditional Name: 1-[2,3-dimethyl-4-[4-(phenethylthiocarbamoylamino)phenoxy]phenyl]-3-phenethyl-thiourea Formula: C32H34N4OS2 MolecularWeight: 554.76856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3)NC(=S)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1C)OC2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3)NC(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C32H34N4OS2/c1-23-24(2)30(18-17-29(23)36-32(39)34-22-20-26-11-7-4-8-12-26)37-28-15-13-27(14-16-28)35-31(38)33-21-19-25-9-5-3-6-10-25/h3-18H,19-22H2,1-2H3,(H2,33,35,38)(H2,34,36,39)