1-[2-[4-[[3,5-bis(oxidanylidene)-1,2,4-thiadiazolidin-2-yl]methyl]phenyl]-5-tert-butyl-pyrazol-3-yl]-3-(4-chlorophenyl)urea

Systemtic Name: 1-[2-[4-[[3,5-bis(oxidanylidene)-1,2,4-thiadiazolidin-2-yl]methyl]phenyl]-5-tert-butyl-pyrazol-3-yl]-3-(4-chlorophenyl)urea Openeye Name: 1-[5-tert-butyl-2-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]pyrazol-3-yl]-3-(4-chlorophenyl)urea CAS Name: 1-[5-tert-butyl-2-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]-3-pyrazolyl]-3-(4-chlorophenyl)urea IUPAC Name: 1-[5-tert-butyl-2-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]pyrazol-3-yl]-3-(4-chlorophenyl)urea Traditional Name: 1-[5-tert-butyl-2-[4-[(3,5-diketo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]pyrazol-3-yl]-3-(4-chlorophenyl)urea Formula: C23H23ClN6O3S MolecularWeight: 498.98512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)CN4C(=O)NC(=O)S4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)CN4C(=O)NC(=O)S4

InChI

InChI=1S/C23H23ClN6O3S/c1-23(2,3)18-12-19(26-20(31)25-16-8-6-15(24)7-9-16)30(28-18)17-10-4-14(5-11-17)13-29-21(32)27-22(33)34-29/h4-12H,13H2,1-3H3,(H2,25,26,31)(H,27,32,33)