1-(4-ethylphenyl)-3-[(2-methylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(4-ethylphenyl)-3-[(2-methylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-ethylphenyl)-3-(o-tolylcarbamothioylamino)thiourea CAS Name: 1-[[(4-ethylanilino)-sulfanylidenemethyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-(4-ethylphenyl)-3-[(2-methylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(4-ethylphenyl)-3-(o-tolylthiocarbamoylamino)thiourea Formula: C17H20N4S2 MolecularWeight: 344.4975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC=C2C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC=CC=C2C

InChI

InChI=1S/C17H20N4S2/c1-3-13-8-10-14(11-9-13)18-16(22)20-21-17(23)19-15-7-5-4-6-12(15)2/h4-11H,3H2,1-2H3,(H2,18,20,22)(H2,19,21,23)