1-(5-chloranyl-2-phenoxy-phenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(5-chloranyl-2-phenoxy-phenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea Openeye Name: 1-(5-chloro-2-phenoxy-phenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea CAS Name: 1-(5-chloro-2-phenoxyphenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea IUPAC Name: 1-(5-chloro-2-phenoxyphenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea Traditional Name: 1-(5-chloro-2-phenoxy-phenyl)-3-[2-(4-methoxyphenyl)ethyl]thiourea Formula: C22H21ClN2O2S MolecularWeight: 412.93234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C22H21ClN2O2S/c1-26-18-10-7-16(8-11-18)13-14-24-22(28)25-20-15-17(23)9-12-21(20)27-19-5-3-2-4-6-19/h2-12,15H,13-14H2,1H3,(H2,24,25,28)