1-ethyl-1-(thiophen-2-ylmethyl)-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-ethyl-1-(thiophen-2-ylmethyl)-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-ethyl-1-(2-thienylmethyl)-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-ethyl-1-(thiophen-2-ylmethyl)-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea IUPAC Name: 1-ethyl-1-(thiophen-2-ylmethyl)-3-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-ethyl-1-(2-thenyl)-3-[4-(1,2,4-triazol-1-ylmethyl)benzyl]urea Formula: C18H21N5OS MolecularWeight: 355.45724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CCN(CC1=CC=CS1)C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H21N5OS/c1-2-22(12-17-4-3-9-25-17)18(24)20-10-15-5-7-16(8-6-15)11-23-14-19-13-21-23/h3-9,13-14H,2,10-12H2,1H3,(H,20,24)