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

Systemtic Name: 1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-pyridin-3-yl-thiourea Openeye Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(3-pyridyl)thiourea CAS Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-pyridin-3-ylthiourea Traditional Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(3-pyridyl)thiourea Formula: C20H19BrN4O3S2 MolecularWeight: 507.42386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC3=CN=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC3=CN=CC=C3

InChI

InChI=1S/C20H19BrN4O3S2/c1-2-28-18-10-5-14(21)12-19(18)30(26,27)25-16-8-6-15(7-9-16)23-20(29)24-17-4-3-11-22-13-17/h3-13,25H,2H2,1H3,(H2,23,24,29)