1-(3-ethylpent-1-yn-3-yl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(3-ethylpent-1-yn-3-yl)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(1,1-diethylprop-2-ynyl)thiourea CAS Name: 1-(3-ethylpent-1-yn-3-yl)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-ethylpent-1-yn-3-yl)thiourea Traditional Name: 1-benzyl-3-(1,1-diethylprop-2-ynyl)thiourea Formula: C15H20N2S MolecularWeight: 260.3977

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CCC(CC)(C#C)NC(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2S/c1-4-15(5-2,6-3)17-14(18)16-12-13-10-8-7-9-11-13/h1,7-11H,5-6,12H2,2-3H3,(H2,16,17,18)