1-(2-ethylhexyl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(2-ethylhexyl)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(2-ethylhexyl)thiourea CAS Name: 1-(2-ethylhexyl)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(2-ethylhexyl)thiourea Traditional Name: 1-benzyl-3-(2-ethylhexyl)thiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC)CNC(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C16H26N2S/c1-3-5-9-14(4-2)12-17-16(19)18-13-15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3,(H2,17,18,19)