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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H19N5O3S/c25-17(20-14-5-6-15-16(10-14)27-12-26-15)13-4-3-9-24(11-13)19-22-21-18(28-19)23-7-1-2-8-23/h1-2,5-8,10,13H,3-4,9,11-12H2,(H,20,25)