1-[2-[(4-pentoxyphenyl)methylsulfanyl]ethyl]-3-phenyl-thiourea

Systemtic Name: 1-[2-[(4-pentoxyphenyl)methylsulfanyl]ethyl]-3-phenyl-thiourea Openeye Name: 1-[2-[(4-pentoxyphenyl)methylsulfanyl]ethyl]-3-phenyl-thiourea CAS Name: 1-[2-[(4-pentoxyphenyl)methylthio]ethyl]-3-phenylthiourea IUPAC Name: 1-[2-[(4-pentoxyphenyl)methylsulfanyl]ethyl]-3-phenylthiourea Traditional Name: 1-[2-[(4-amoxybenzyl)thio]ethyl]-3-phenyl-thiourea Formula: C21H28N2OS2 MolecularWeight: 388.58982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)CSCCNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)CSCCNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C21H28N2OS2/c1-2-3-7-15-24-20-12-10-18(11-13-20)17-26-16-14-22-21(25)23-19-8-5-4-6-9-19/h4-6,8-13H,2-3,7,14-17H2,1H3,(H2,22,23,25)