1-(3-chloranyl-2-methyl-phenyl)-3-[[5-(furan-2-ylmethylsulfamoyl)pyridin-2-yl]amino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[[5-(furan-2-ylmethylsulfamoyl)pyridin-2-yl]amino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[[5-(2-furylmethylsulfamoyl)-2-pyridyl]amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[5-(2-furanylmethylsulfamoyl)-2-pyridinyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[[5-(furan-2-ylmethylsulfamoyl)pyridin-2-yl]amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[[5-(2-furfurylsulfamoyl)-2-pyridyl]amino]thiourea Formula: C18H18ClN5O3S2 MolecularWeight: 451.95022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC2=NC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC2=NC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H18ClN5O3S2/c1-12-15(19)5-2-6-16(12)22-18(28)24-23-17-8-7-14(11-20-17)29(25,26)21-10-13-4-3-9-27-13/h2-9,11,21H,10H2,1H3,(H,20,23)(H2,22,24,28)