1-[[4-[(2-bromanylphenoxy)methyl]phenyl]carbonylamino]-3-(2,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[[4-[(2-bromanylphenoxy)methyl]phenyl]carbonylamino]-3-(2,4-dimethoxyphenyl)thiourea Openeye Name: 1-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]-3-(2,4-dimethoxyphenyl)thiourea CAS Name: 1-[[[4-[(2-bromophenoxy)methyl]phenyl]-oxomethyl]amino]-3-(2,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]-3-(2,4-dimethoxyphenyl)thiourea Traditional Name: 1-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]-3-(2,4-dimethoxyphenyl)thiourea Formula: C23H22BrN3O4S MolecularWeight: 516.40748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3Br)OC

InChI

InChI=1S/C23H22BrN3O4S/c1-29-17-11-12-19(21(13-17)30-2)25-23(32)27-26-22(28)16-9-7-15(8-10-16)14-31-20-6-4-3-5-18(20)24/h3-13H,14H2,1-2H3,(H,26,28)(H2,25,27,32)