1-(3-chloranyl-2-methyl-phenyl)-3-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(5-pyrrolidin-1-ylsulfonylfuran-2-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[oxo-[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(5-pyrrolidin-1-ylsulfonylfuran-2-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(5-pyrrolidinosulfonyl-2-furoyl)amino]thiourea Formula: C17H19ClN4O4S2 MolecularWeight: 442.94016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H19ClN4O4S2/c1-11-12(18)5-4-6-13(11)19-17(27)21-20-16(23)14-7-8-15(26-14)28(24,25)22-9-2-3-10-22/h4-8H,2-3,9-10H2,1H3,(H,20,23)(H2,19,21,27)