1-(4-ethanoylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea

Systemtic Name: 1-(4-ethanoylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Openeye Name: 1-(4-acetylphenyl)-3-(1,1-diethylprop-2-ynyl)thiourea CAS Name: 1-(4-acetylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea IUPAC Name: 1-(4-acetylphenyl)-3-(3-ethylpent-1-yn-3-yl)thiourea Traditional Name: 1-(4-acetylphenyl)-3-(1,1-diethylprop-2-ynyl)thiourea Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=S)NC1=CC=C(C=C1)C(=O)C

Isomeric SMILES

CCC(CC)(C#C)NC(=S)NC1=CC=C(C=C1)C(=O)C

InChI

InChI=1S/C16H20N2OS/c1-5-16(6-2,7-3)18-15(20)17-14-10-8-13(9-11-14)12(4)19/h1,8-11H,6-7H2,2-4H3,(H2,17,18,20)