methyl 3-[5-[2-(methylamino)-2-adamantyl]-1,2,3,4-tetrazol-1-yl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[5-[2-(methylamino)-2-adamantyl]-1,2,3,4-tetrazol-1-yl]thiophene-2-carboxylate Openeye Name: methyl 3-[5-[2-(methylamino)-2-adamantyl]tetrazol-1-yl]thiophene-2-carboxylate CAS Name: 3-[5-[2-(methylamino)-2-adamantyl]-1-tetrazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[5-[2-(methylamino)-2-adamantyl]tetrazol-1-yl]thiophene-2-carboxylate Traditional Name: 3-[5-[2-(methylamino)-2-adamantyl]tetrazol-1-yl]thiophene-2-carboxylic acid methyl ester Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CNC1(C2CC3CC(C2)CC1C3)C4=NN=NN4C5=C(SC=C5)C(=O)OC

Isomeric SMILES

CNC1(C2CC3CC(C2)CC1C3)C4=NN=NN4C5=C(SC=C5)C(=O)OC

InChI

InChI=1S/C18H23N5O2S/c1-19-18(12-6-10-5-11(8-12)9-13(18)7-10)17-20-21-22-23(17)14-3-4-26-15(14)16(24)25-2/h3-4,10-13,19H,5-9H2,1-2H3