N-(4-morpholin-4-ylsulfonylphenyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(4-morpholinosulfonylphenyl)-4-pyrimidin-2-yl-piperazine-1-carbothioamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-4-(2-pyrimidinyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-4-pyrimidin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(4-morpholinosulfonylphenyl)-4-(2-pyrimidyl)piperazine-1-carbothioamide Formula: C19H24N6O3S2 MolecularWeight: 448.56226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C19H24N6O3S2/c26-30(27,25-12-14-28-15-13-25)17-4-2-16(3-5-17)22-19(29)24-10-8-23(9-11-24)18-20-6-1-7-21-18/h1-7H,8-15H2,(H,22,29)