ethyl 2-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(1-methyltetrazol-5-yl)sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(1-methyl-5-tetrazolyl)thio]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(1-methyltetrazol-5-yl)sulfanylpropanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[(1-methyltetrazol-5-yl)thio]propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NN=NN3C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NN=NN3C

InChI

InChI=1S/C18H19N5O3S2/c1-4-26-17(25)13-10-14(12-8-6-5-7-9-12)28-16(13)19-15(24)11(2)27-18-20-21-22-23(18)3/h5-11H,4H2,1-3H3,(H,19,24)