[2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-oxidanylidene-ethyl] 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: [2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-oxidanylidene-ethyl] 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: [2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-oxo-ethyl] 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid [2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-oxoethyl] 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid [2-[4-[(1R)-1-acetamidoethyl]phenyl]-2-keto-ethyl] ester Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)COC(=O)CN2N=C(N=N2)C3=CSC=C3)NC(=O)C

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)C(=O)COC(=O)CN2N=C(N=N2)C3=CSC=C3)NC(=O)C

InChI

InChI=1S/C19H19N5O4S/c1-12(20-13(2)25)14-3-5-15(6-4-14)17(26)10-28-18(27)9-24-22-19(21-23-24)16-7-8-29-11-16/h3-8,11-12H,9-10H2,1-2H3,(H,20,25)/t12-/m1/s1