1-(4-methoxyphenyl)-3-[4-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazol-2-yl]urea

Systemtic Name: 1-(4-methoxyphenyl)-3-[4-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazol-2-yl]urea Openeye Name: 1-(4-methoxyphenyl)-3-[4-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]thiazol-2-yl]urea CAS Name: 1-(4-methoxyphenyl)-3-[4-[3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-2-thiazolyl]urea IUPAC Name: 1-(4-methoxyphenyl)-3-[4-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-thiazol-2-yl]urea Traditional Name: 1-[4-[3-keto-3-[4-(2-pyrimidyl)piperazino]propyl]thiazol-2-yl]-3-(4-methoxyphenyl)urea Formula: C22H25N7O3S MolecularWeight: 467.544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H25N7O3S/c1-32-18-6-3-16(4-7-18)25-21(31)27-22-26-17(15-33-22)5-8-19(30)28-11-13-29(14-12-28)20-23-9-2-10-24-20/h2-4,6-7,9-10,15H,5,8,11-14H2,1H3,(H2,25,26,27,31)