1-[3-(4-chlorophenyl)propyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea

Systemtic Name: 1-[3-(4-chlorophenyl)propyl]-3-[(3-methoxy-4-oxidanyl-phenyl)methyl]thiourea Openeye Name: 1-[3-(4-chlorophenyl)propyl]-3-[(4-hydroxy-3-methoxy-phenyl)methyl]thiourea CAS Name: 1-[3-(4-chlorophenyl)propyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[3-(4-chlorophenyl)propyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]thiourea Traditional Name: 1-[3-(4-chlorophenyl)propyl]-3-vanillyl-thiourea Formula: C18H21ClN2O2S MolecularWeight: 364.88954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=S)NCCCC2=CC=C(C=C2)Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=S)NCCCC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C18H21ClN2O2S/c1-23-17-11-14(6-9-16(17)22)12-21-18(24)20-10-2-3-13-4-7-15(19)8-5-13/h4-9,11,22H,2-3,10,12H2,1H3,(H2,20,21,24)