1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]thiourea CAS Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]thiourea Traditional Name: 1-benzyl-3-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]thiourea Formula: C22H22BrN3O3S2 MolecularWeight: 520.46238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C22H22BrN3O3S2/c1-2-29-20-13-8-17(23)14-21(20)31(27,28)26-19-11-9-18(10-12-19)25-22(30)24-15-16-6-4-3-5-7-16/h3-14,26H,2,15H2,1H3,(H2,24,25,30)