5-methyl-N-[[1-[(2-methylsulfanylphenyl)carbamoyl]piperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-[[1-[(2-methylsulfanylphenyl)carbamoyl]piperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-[[1-[(2-methylsulfanylphenyl)carbamoyl]-3-piperidyl]methyl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-[[1-[[2-(methylthio)anilino]-oxomethyl]-3-piperidinyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[[1-[(2-methylsulfanylphenyl)carbamoyl]piperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-methyl-N-[[1-[[2-(methylthio)phenyl]carbamoyl]-3-piperidyl]methyl]isoxazole-3-carboxamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NCC2CCCN(C2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CC1=CC(=NO1)C(=O)NCC2CCCN(C2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C19H24N4O3S/c1-13-10-16(22-26-13)18(24)20-11-14-6-5-9-23(12-14)19(25)21-15-7-3-4-8-17(15)27-2/h3-4,7-8,10,14H,5-6,9,11-12H2,1-2H3,(H,20,24)(H,21,25)