1,1-bis(prop-2-enyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1,1-bis(prop-2-enyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1,1-diallyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1,1-bis(prop-2-enyl)-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1,1-bis(prop-2-enyl)-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1,1-diallyl-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C17H19N5O2S2 MolecularWeight: 389.49506

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2

Isomeric SMILES

C=CCN(CC=C)C(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2

InChI

InChI=1S/C17H19N5O2S2/c1-3-12-22(13-4-2)17(25)20-14-6-8-15(9-7-14)26(23,24)21-16-18-10-5-11-19-16/h3-11H,1-2,12-13H2,(H,20,25)(H,18,19,21)