(4-acetamidophenyl) 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate

Systemtic Name: (4-acetamidophenyl) 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoate Openeye Name: (4-acetamidophenyl) 2-(1-cyclopropyltetrazol-5-yl)sulfanylacetate CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)thio]acetic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-(1-cyclopropyltetrazol-5-yl)sulfanylacetate Traditional Name: 2-[(1-cyclopropyltetrazol-5-yl)thio]acetic acid (4-acetamidophenyl) ester Formula: C14H15N5O3S MolecularWeight: 333.3656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)CSC2=NN=NN2C3CC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)CSC2=NN=NN2C3CC3

InChI

InChI=1S/C14H15N5O3S/c1-9(20)15-10-2-6-12(7-3-10)22-13(21)8-23-14-16-17-18-19(14)11-4-5-11/h2-3,6-7,11H,4-5,8H2,1H3,(H,15,20)