1-(3-chloranyl-2-methyl-phenyl)-3-(phenethylcarbamothioylamino)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(phenethylcarbamothioylamino)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(phenethylcarbamothioylamino)thiourea CAS Name: 1-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-3-phenethylthiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(phenethylcarbamothioylamino)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(phenethylthiocarbamoylamino)thiourea Formula: C17H19ClN4S2 MolecularWeight: 378.94256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H19ClN4S2/c1-12-14(18)8-5-9-15(12)20-17(24)22-21-16(23)19-11-10-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H2,19,21,23)(H2,20,22,24)