[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: [2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl] 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: [2-[1-(1-naphthyl)ethylamino]-2-oxo-ethyl] 2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetate CAS Name: 2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetic acid [2-[1-(1-naphthalenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-(1-naphthalen-1-ylethylamino)-2-oxoethyl] 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid [2-keto-2-[1-(1-naphthyl)ethylamino]ethyl] ester Formula: C21H19N5O4S MolecularWeight: 437.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)COC(=O)CN3C(=O)N(N=N3)C4=CC=CS4

InChI

InChI=1S/C21H19N5O4S/c1-14(16-9-4-7-15-6-2-3-8-17(15)16)22-18(27)13-30-20(28)12-25-21(29)26(24-23-25)19-10-5-11-31-19/h2-11,14H,12-13H2,1H3,(H,22,27)