1-[2-(4-azanyl-2-methyl-phenyl)sulfanylethanoyl]piperidine-3-carboxamide

Systemtic Name: 1-[2-(4-azanyl-2-methyl-phenyl)sulfanylethanoyl]piperidine-3-carboxamide Openeye Name: 1-[2-(4-amino-2-methyl-phenyl)sulfanylacetyl]piperidine-3-carboxamide CAS Name: 1-[2-[(4-amino-2-methylphenyl)thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: 1-[2-(4-amino-2-methylphenyl)sulfanylacetyl]piperidine-3-carboxamide Traditional Name: 1-[2-[(4-amino-2-methyl-phenyl)thio]acetyl]nipecotamide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC(=O)N2CCCC(C2)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC(=O)N2CCCC(C2)C(=O)N

InChI

InChI=1S/C15H21N3O2S/c1-10-7-12(16)4-5-13(10)21-9-14(19)18-6-2-3-11(8-18)15(17)20/h4-5,7,11H,2-3,6,8-9,16H2,1H3,(H2,17,20)