1-[2-(4-bromophenyl)sulfanylethyl]-3-[(3,4,5-trimethoxyphenyl)carbonylamino]urea

Systemtic Name: 1-[2-(4-bromophenyl)sulfanylethyl]-3-[(3,4,5-trimethoxyphenyl)carbonylamino]urea Openeye Name: 1-[2-(4-bromophenyl)sulfanylethyl]-3-[(3,4,5-trimethoxybenzoyl)amino]urea CAS Name: 1-[2-[(4-bromophenyl)thio]ethyl]-3-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]urea IUPAC Name: 1-[2-(4-bromophenyl)sulfanylethyl]-3-[(3,4,5-trimethoxybenzoyl)amino]urea Traditional Name: 1-[2-[(4-bromophenyl)thio]ethyl]-3-[(3,4,5-trimethoxybenzoyl)amino]urea Formula: C19H22BrN3O5S MolecularWeight: 484.36408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H22BrN3O5S/c1-26-15-10-12(11-16(27-2)17(15)28-3)18(24)22-23-19(25)21-8-9-29-14-6-4-13(20)5-7-14/h4-7,10-11H,8-9H2,1-3H3,(H,22,24)(H2,21,23,25)