1-[2,4-bis(fluoranyl)phenyl]-3-[(4-ethylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-3-[(4-ethylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(2,4-difluorophenyl)-3-[(4-ethylphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2,4-difluoroanilino)-sulfanylidenemethyl]amino]-3-(4-ethylphenyl)thiourea IUPAC Name: 1-(2,4-difluorophenyl)-3-[(4-ethylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(2,4-difluorophenyl)-3-[(4-ethylphenyl)thiocarbamoylamino]thiourea Formula: C16H16F2N4S2 MolecularWeight: 366.451846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C16H16F2N4S2/c1-2-10-3-6-12(7-4-10)19-15(23)21-22-16(24)20-14-8-5-11(17)9-13(14)18/h3-9H,2H2,1H3,(H2,19,21,23)(H2,20,22,24)