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

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: [2-(azepan-1-yl)-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-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-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-(azepan-1-yl)-2-keto-ethyl] ester Formula: C15H19N5O4S MolecularWeight: 365.40746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C15H19N5O4S/c21-12(18-7-3-1-2-4-8-18)11-24-14(22)10-19-15(23)20(17-16-19)13-6-5-9-25-13/h5-6,9H,1-4,7-8,10-11H2