1-[1-(4-butan-2-ylphenyl)ethyl]-3-phenethyl-thiourea

Systemtic Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-phenethyl-thiourea Openeye Name: 1-phenethyl-3-[1-(4-sec-butylphenyl)ethyl]thiourea CAS Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-phenethylthiourea IUPAC Name: 1-[1-(4-butan-2-ylphenyl)ethyl]-3-phenethylthiourea Traditional Name: 1-phenethyl-3-[1-(4-sec-butylphenyl)ethyl]thiourea Formula: C21H28N2S MolecularWeight: 340.52542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C)NC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C)NC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2S/c1-4-16(2)19-10-12-20(13-11-19)17(3)23-21(24)22-15-14-18-8-6-5-7-9-18/h5-13,16-17H,4,14-15H2,1-3H3,(H2,22,23,24)