3-(2-ethyl-6-methyl-phenyl)-1-(3-methylbutyl)-1-(1-thiophen-2-ylethyl)thiourea

Systemtic Name: 3-(2-ethyl-6-methyl-phenyl)-1-(3-methylbutyl)-1-(1-thiophen-2-ylethyl)thiourea Openeye Name: 3-(2-ethyl-6-methyl-phenyl)-1-isopentyl-1-[1-(2-thienyl)ethyl]thiourea CAS Name: 3-(2-ethyl-6-methylphenyl)-1-(3-methylbutyl)-1-(1-thiophen-2-ylethyl)thiourea IUPAC Name: 3-(2-ethyl-6-methylphenyl)-1-(3-methylbutyl)-1-(1-thiophen-2-ylethyl)thiourea Traditional Name: 3-(2-ethyl-6-methyl-phenyl)-1-isoamyl-1-[1-(2-thienyl)ethyl]thiourea Formula: C21H30N2S2 MolecularWeight: 374.6063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N(CCC(C)C)C(C)C2=CC=CS2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N(CCC(C)C)C(C)C2=CC=CS2)C

InChI

InChI=1S/C21H30N2S2/c1-6-18-10-7-9-16(4)20(18)22-21(24)23(13-12-15(2)3)17(5)19-11-8-14-25-19/h7-11,14-15,17H,6,12-13H2,1-5H3,(H,22,24)