N-(3-methylbutyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-isopentyl-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-isoamyl-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1CCCN(C1)C2=NN=C(S2)N3C=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)C1CCCN(C1)C2=NN=C(S2)N3C=CC=C3

InChI

InChI=1S/C17H25N5OS/c1-13(2)7-8-18-15(23)14-6-5-11-22(12-14)17-20-19-16(24-17)21-9-3-4-10-21/h3-4,9-10,13-14H,5-8,11-12H2,1-2H3,(H,18,23)