N-(3-methylbutyl)-1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-4-carboxamide Openeye Name: N-isopentyl-1-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-4-carboxamide CAS Name: N-(3-methylbutyl)-1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-4-piperidinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-4-carboxamide Traditional Name: N-isoamyl-1-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]isonipecotamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCC(CC3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCC(CC3)C(=O)NCCC(C)C

InChI

InChI=1S/C21H30N4OS/c1-15(2)8-11-22-20(26)18-9-12-25(13-10-18)21-23-19(24-27-21)14-17-6-4-16(3)5-7-17/h4-7,15,18H,8-14H2,1-3H3,(H,22,26)