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

Systemtic Name: 1-[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2-thienylmethyl)thiourea CAS Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-3-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]-3-(2-thenyl)thiourea Formula: C20H20BrN3O3S3 MolecularWeight: 526.4901

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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=CS3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NCC3=CC=CS3

InChI

InChI=1S/C20H20BrN3O3S3/c1-2-27-18-10-5-14(21)12-19(18)30(25,26)24-16-8-6-15(7-9-16)23-20(28)22-13-17-4-3-11-29-17/h3-12,24H,2,13H2,1H3,(H2,22,23,28)