1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-3-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-3-(thiophen-2-ylmethyl)urea Openeye Name: 1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-3-(2-thienylmethyl)urea CAS Name: 1-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]-3-(thiophen-2-ylmethyl)urea IUPAC Name: 1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]-3-(thiophen-2-ylmethyl)urea Traditional Name: 1-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]-3-(2-thenyl)urea Formula: C16H22N6O3S2 MolecularWeight: 410.51428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCNC(=O)NCC3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCNC(=O)NCC3=CC=CS3

InChI

InChI=1S/C16H22N6O3S2/c23-16(20-13-14-3-1-11-26-14)19-6-12-27(24,25)22-9-7-21(8-10-22)15-17-4-2-5-18-15/h1-5,11H,6-10,12-13H2,(H2,19,20,23)