4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide Openeye Name: 4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]-N-[4-(4-pyridyl)thiazol-2-yl]benzamide CAS Name: 4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]-N-(4-pyridin-4-yl-2-thiazolyl)benzamide IUPAC Name: 4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide Traditional Name: 4-[(2S)-2-methylpiperidino]sulfonyl-N-[4-(4-pyridyl)thiazol-2-yl]benzamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=NC=C4

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=NC=C4

InChI

InChI=1S/C21H22N4O3S2/c1-15-4-2-3-13-25(15)30(27,28)18-7-5-17(6-8-18)20(26)24-21-23-19(14-29-21)16-9-11-22-12-10-16/h5-12,14-15H,2-4,13H2,1H3,(H,23,24,26)/t15-/m0/s1