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

Systemtic Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: [2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl] 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid [2-keto-2-(3-methylbenzothiophen-2-yl)ethyl] ester Formula: C18H14N4O3S2 MolecularWeight: 398.45876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)CN3N=C(N=N3)C4=CSC=C4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)CN3N=C(N=N3)C4=CSC=C4

InChI

InChI=1S/C18H14N4O3S2/c1-11-13-4-2-3-5-15(13)27-17(11)14(23)9-25-16(24)8-22-20-18(19-21-22)12-6-7-26-10-12/h2-7,10H,8-9H2,1H3