1-(4-butan-2-ylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Openeye Name: 1-(1,1-diethylprop-2-ynyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Traditional Name: 1-(1,1-diethylprop-2-ynyl)-3-(4-sec-butylphenyl)thiourea Formula: C18H26N2S MolecularWeight: 302.47744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC(CC)(CC)C#C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NC(CC)(CC)C#C

InChI

InChI=1S/C18H26N2S/c1-6-14(5)15-10-12-16(13-11-15)19-17(21)20-18(7-2,8-3)9-4/h2,10-14H,6,8-9H2,1,3-5H3,(H2,19,20,21)