1-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]thiourea CAS Name: 1-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-benzyl-3-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]thiourea Formula: C18H21BrN2O2S MolecularWeight: 409.34054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=S)NCC2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=S)NCC2=CC=CC=C2)Br)OC

InChI

InChI=1S/C18H21BrN2O2S/c1-22-16-10-14(15(19)11-17(16)23-2)8-9-20-18(24)21-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H2,20,21,24)