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

Systemtic Name: 1-[[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]carbonylamino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoyl]amino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoyl]amino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoyl]amino]-3-(tetrahydrofurfuryl)thiourea Formula: C21H25BrN4O5S2 MolecularWeight: 557.481

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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)C(=O)NNC(=S)NCC3CCCO3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NCC3CCCO3

InChI

InChI=1S/C21H25BrN4O5S2/c1-2-30-18-10-7-15(22)12-19(18)33(28,29)26-16-8-5-14(6-9-16)20(27)24-25-21(32)23-13-17-4-3-11-31-17/h5-10,12,17,26H,2-4,11,13H2,1H3,(H,24,27)(H2,23,25,32)