2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-(3-chloranyl-4-methyl-phenyl)sulfonylpiperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]-N-methyl-N-prop-2-ynyl-thiazole-4-carboxamide CAS Name: 2-[1-(3-chloro-4-methylphenyl)sulfonyl-4-piperidinyl]-N-methyl-N-prop-2-ynyl-4-thiazolecarboxamide IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-4-yl]-N-methyl-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-(3-chloro-4-methyl-phenyl)sulfonyl-4-piperidyl]-N-methyl-N-propargyl-thiazole-4-carboxamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)N(C)CC#C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)N(C)CC#C)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-4-9-23(3)20(25)18-13-28-19(22-18)15-7-10-24(11-8-15)29(26,27)16-6-5-14(2)17(21)12-16/h1,5-6,12-13,15H,7-11H2,2-3H3