[1-[[2,3-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: [1-[[2,3-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: [2-(2,3-dichloroanilino)-1-methyl-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 [1-(2,3-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid [2-(2,3-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C16H13Cl2N5O4S MolecularWeight: 442.27652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=CC=C1)Cl)Cl)OC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=C(C(=CC=C1)Cl)Cl)OC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C16H13Cl2N5O4S/c1-9(15(25)19-11-5-2-4-10(17)14(11)18)27-13(24)8-22-16(26)23(21-20-22)12-6-3-7-28-12/h2-7,9H,8H2,1H3,(H,19,25)