3,4,5-triethoxy-N-[5-(2-pyrrolidin-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,4,5-triethoxy-N-[5-(2-pyrrolidin-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,4,5-triethoxy-N-[5-(2-pyrrolidin-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,4,5-triethoxy-N-[5-[2-(1-pyrrolidinyl)ethyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,4,5-triethoxy-N-[5-(2-pyrrolidin-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,4,5-triethoxy-N-[5-(2-pyrrolidinoethyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)CCN3CCCC3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)CCN3CCCC3

InChI

InChI=1S/C21H30N4O4S/c1-4-27-16-13-15(14-17(28-5-2)19(16)29-6-3)20(26)22-21-24-23-18(30-21)9-12-25-10-7-8-11-25/h13-14H,4-12H2,1-3H3,(H,22,24,26)