1-[(4-chlorophenyl)methyl]-3-(2-ethylhexyl)thiourea

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-(2-ethylhexyl)thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-(2-ethylhexyl)thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-(2-ethylhexyl)thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-(2-ethylhexyl)thiourea Traditional Name: 1-(4-chlorobenzyl)-3-(2-ethylhexyl)thiourea Formula: C16H25ClN2S MolecularWeight: 312.9011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2S/c1-3-5-6-13(4-2)11-18-16(20)19-12-14-7-9-15(17)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3,(H2,18,19,20)