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

Systemtic Name: 1-[2-[(4-butoxy-3-chloranyl-phenyl)methylsulfanyl]ethyl]-3-phenyl-thiourea Openeye Name: 1-[2-[(4-butoxy-3-chloro-phenyl)methylsulfanyl]ethyl]-3-phenyl-thiourea CAS Name: 1-[2-[(4-butoxy-3-chlorophenyl)methylthio]ethyl]-3-phenylthiourea IUPAC Name: 1-[2-[(4-butoxy-3-chlorophenyl)methylsulfanyl]ethyl]-3-phenylthiourea Traditional Name: 1-[2-[(4-butoxy-3-chloro-benzyl)thio]ethyl]-3-phenyl-thiourea Formula: C20H25ClN2OS2 MolecularWeight: 409.0083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CSCCNC(=S)NC2=CC=CC=C2)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CSCCNC(=S)NC2=CC=CC=C2)Cl

InChI

InChI=1S/C20H25ClN2OS2/c1-2-3-12-24-19-10-9-16(14-18(19)21)15-26-13-11-22-20(25)23-17-7-5-4-6-8-17/h4-10,14H,2-3,11-13,15H2,1H3,(H2,22,23,25)