1-[2-(4-chlorophenyl)sulfanylethyl]-3-(4,5-dimethoxy-2-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-(4,5-dimethoxy-2-methyl-phenyl)thiourea Openeye Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-(4,5-dimethoxy-2-methyl-phenyl)thiourea CAS Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-(4,5-dimethoxy-2-methylphenyl)thiourea IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-(4,5-dimethoxy-2-methylphenyl)thiourea Traditional Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-(4,5-dimethoxy-2-methyl-phenyl)thiourea Formula: C18H21ClN2O2S2 MolecularWeight: 396.95454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=S)NCCSC2=CC=C(C=C2)Cl)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=S)NCCSC2=CC=C(C=C2)Cl)OC)OC

InChI

InChI=1S/C18H21ClN2O2S2/c1-12-10-16(22-2)17(23-3)11-15(12)21-18(24)20-8-9-25-14-6-4-13(19)5-7-14/h4-7,10-11H,8-9H2,1-3H3,(H2,20,21,24)