1-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-pyridyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[6-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-pyridinyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]pyridin-3-yl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[6-[4-(2-thenoyl)piperazino]-3-pyridyl]-3-[4-(trifluoromethyl)phenyl]urea Formula: C22H20F3N5O2S MolecularWeight: 475.48671

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H20F3N5O2S/c23-22(24,25)15-3-5-16(6-4-15)27-21(32)28-17-7-8-19(26-14-17)29-9-11-30(12-10-29)20(31)18-2-1-13-33-18/h1-8,13-14H,9-12H2,(H2,27,28,32)