1-[(4R)-4-ethyl-4-[(phenylcarbamothioylamino)methyl]octyl]-3-phenyl-thiourea

Systemtic Name: 1-[(4R)-4-ethyl-4-[(phenylcarbamothioylamino)methyl]octyl]-3-phenyl-thiourea Openeye Name: 1-[(4R)-4-ethyl-4-[(phenylcarbamothioylamino)methyl]octyl]-3-phenyl-thiourea CAS Name: 1-[(4R)-4-[[[anilino(sulfanylidene)methyl]amino]methyl]-4-ethyloctyl]-3-phenylthiourea IUPAC Name: 1-[(4R)-4-ethyl-4-[(phenylcarbamothioylamino)methyl]octyl]-3-phenylthiourea Traditional Name: 1-[(4R)-4-ethyl-4-[(phenylthiocarbamoylamino)methyl]octyl]-3-phenyl-thiourea Formula: C25H36N4S2 MolecularWeight: 456.71014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CCCNC(=S)NC1=CC=CC=C1)CNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCCC[C@](CC)(CCCNC(=S)NC1=CC=CC=C1)CNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C25H36N4S2/c1-3-5-17-25(4-2,20-27-24(31)29-22-15-10-7-11-16-22)18-12-19-26-23(30)28-21-13-8-6-9-14-21/h6-11,13-16H,3-5,12,17-20H2,1-2H3,(H2,26,28,30)(H2,27,29,31)/t25-/m1/s1