1-(5-methylthiophen-2-yl)sulfonyl-N-(2-phenylpyrimidin-5-yl)piperidine-3-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-(2-phenylpyrimidin-5-yl)piperidine-3-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-(2-phenylpyrimidin-5-yl)piperidine-3-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-(2-phenyl-5-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-(2-phenylpyrimidin-5-yl)piperidine-3-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-(2-phenylpyrimidin-5-yl)nipecotamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S2/c1-15-9-10-19(29-15)30(27,28)25-11-5-8-17(14-25)21(26)24-18-12-22-20(23-13-18)16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13,17H,5,8,11,14H2,1H3,(H,24,26)