1-[4-[[3,5-bis(oxidanylidene)-1,2,4-thiadiazolidin-2-yl]methyl]phenyl]-3-[4-methyl-3-(pyrimidin-2-ylamino)phenyl]urea

Systemtic Name: 1-[4-[[3,5-bis(oxidanylidene)-1,2,4-thiadiazolidin-2-yl]methyl]phenyl]-3-[4-methyl-3-(pyrimidin-2-ylamino)phenyl]urea Openeye Name: 1-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]-3-[4-methyl-3-(pyrimidin-2-ylamino)phenyl]urea CAS Name: 1-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]-3-[4-methyl-3-(2-pyrimidinylamino)phenyl]urea IUPAC Name: 1-[4-[(3,5-dioxo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]-3-[4-methyl-3-(pyrimidin-2-ylamino)phenyl]urea Traditional Name: 1-[4-[(3,5-diketo-1,2,4-thiadiazolidin-2-yl)methyl]phenyl]-3-[4-methyl-3-(2-pyrimidylamino)phenyl]urea Formula: C21H19N7O3S MolecularWeight: 449.48566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3C(=O)NC(=O)S3)NC4=NC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3C(=O)NC(=O)S3)NC4=NC=CC=N4

InChI

InChI=1S/C21H19N7O3S/c1-13-3-6-16(11-17(13)26-18-22-9-2-10-23-18)25-19(29)24-15-7-4-14(5-8-15)12-28-20(30)27-21(31)32-28/h2-11H,12H2,1H3,(H,22,23,26)(H2,24,25,29)(H,27,30,31)