N-(4-phenylbutan-2-yl)-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide

Systemtic Name: N-(4-phenylbutan-2-yl)-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide Openeye Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(1-methyl-3-phenyl-propyl)piperidine-3-carboxamide CAS Name: N-(4-phenylbutan-2-yl)-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-3-piperidinecarboxamide IUPAC Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-phenylbutan-2-yl)piperidine-3-carboxamide Traditional Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(1-methyl-3-phenyl-propyl)nipecotamide Formula: C25H30N4OS MolecularWeight: 434.5969

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCCN(C2)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CCCN(C2)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4OS/c1-19(14-15-20-9-4-2-5-10-20)26-24(30)22-13-8-16-29(18-22)25-27-23(28-31-25)17-21-11-6-3-7-12-21/h2-7,9-12,19,22H,8,13-18H2,1H3,(H,26,30)