(3S)-N-butyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-butyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide Openeye Name: (3S)-N-butyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide CAS Name: (3S)-N-butyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-butyl-1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide Traditional Name: (3S)-N-butyl-1-(3-m-anisyl-1,2,4-thiadiazol-5-yl)nipecotamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCCN(C1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCNC(=O)[C@H]1CCCN(C1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H28N4O2S/c1-3-4-10-21-19(25)16-8-6-11-24(14-16)20-22-18(23-27-20)13-15-7-5-9-17(12-15)26-2/h5,7,9,12,16H,3-4,6,8,10-11,13-14H2,1-2H3,(H,21,25)/t16-/m0/s1