1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-3-ethyl-thiourea

Systemtic Name: 1-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-3-ethyl-thiourea Openeye Name: 1-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]amino]-3-ethyl-thiourea CAS Name: 1-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]amino]-3-ethylthiourea Traditional Name: 1-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]amino]-3-ethyl-thiourea Formula: C13H18BrN3OS2 MolecularWeight: 376.33552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CSC1=C(C=C(C(=C1)C)Br)C

Isomeric SMILES

CCNC(=S)NNC(=O)CSC1=C(C=C(C(=C1)C)Br)C

InChI

InChI=1S/C13H18BrN3OS2/c1-4-15-13(19)17-16-12(18)7-20-11-6-8(2)10(14)5-9(11)3/h5-6H,4,7H2,1-3H3,(H,16,18)(H2,15,17,19)