N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)nipecotamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3CCCN(C3)C4=NN=C(S4)N5C=CC=C5

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3CCCN(C3)C4=NN=C(S4)N5C=CC=C5

InChI

InChI=1S/C22H25N5O3S/c1-15(16-6-7-18-19(13-16)30-12-11-29-18)23-20(28)17-5-4-10-27(14-17)22-25-24-21(31-22)26-8-2-3-9-26/h2-3,6-9,13,15,17H,4-5,10-12,14H2,1H3,(H,23,28)