1-(4-butan-2-ylphenyl)-3-heptan-2-yl-thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-heptan-2-yl-thiourea Openeye Name: 1-(1-methylhexyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-heptan-2-ylthiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-heptan-2-ylthiourea Traditional Name: 1-(1-methylhexyl)-3-(4-sec-butylphenyl)thiourea Formula: C18H30N2S MolecularWeight: 306.5092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=S)NC1=CC=C(C=C1)C(C)CC

Isomeric SMILES

CCCCCC(C)NC(=S)NC1=CC=C(C=C1)C(C)CC

InChI

InChI=1S/C18H30N2S/c1-5-7-8-9-15(4)19-18(21)20-17-12-10-16(11-13-17)14(3)6-2/h10-15H,5-9H2,1-4H3,(H2,19,20,21)