[1-(5-bromanyl-1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl] 2-ethoxybenzoate

Systemtic Name: [1-(5-bromanyl-1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl] 2-ethoxybenzoate Openeye Name: [1-(5-bromo-1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl] 2-ethoxybenzoate CAS Name: 2-ethoxybenzoic acid [1-(5-bromo-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl] ester IUPAC Name: [1-(5-bromo-1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl] 2-ethoxybenzoate Traditional Name: 2-ethoxybenzoic acid [1-(5-bromo-1,3,4-thiadiazol-2-yl)pyrrolidin-3-yl] ester Formula: C15H16BrN3O3S MolecularWeight: 398.27484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)OC2CCN(C2)C3=NN=C(S3)Br

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)OC2CCN(C2)C3=NN=C(S3)Br

InChI

InChI=1S/C15H16BrN3O3S/c1-2-21-12-6-4-3-5-11(12)13(20)22-10-7-8-19(9-10)15-18-17-14(16)23-15/h3-6,10H,2,7-9H2,1H3