1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3,4-dimethoxyphenyl)methyl]thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3,4-dimethoxyphenyl)methyl]thiourea Openeye Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3,4-dimethoxyphenyl)methyl]thiourea CAS Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-[(3,4-dimethoxyphenyl)methyl]thiourea IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(3,4-dimethoxyphenyl)methyl]thiourea Traditional Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-veratryl-thiourea Formula: C18H21ClN2O2S2 MolecularWeight: 396.95454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=S)NCCSC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=S)NCCSC2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C18H21ClN2O2S2/c1-22-16-8-3-13(11-17(16)23-2)12-21-18(24)20-9-10-25-15-6-4-14(19)5-7-15/h3-8,11H,9-10,12H2,1-2H3,(H2,20,21,24)