1-[3-(2-ethoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[3-(2-ethoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[3-(2-ethoxyethoxy)-5-(2-thienyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[3-(2-ethoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[3-(2-ethoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[3-(2-ethoxyethoxy)-5-(2-thienyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=NN(C(=N1)C2=CC=CS2)C(=O)CC(C)(C)C

Isomeric SMILES

CCOCCOC1=NN(C(=N1)C2=CC=CS2)C(=O)CC(C)(C)C

InChI

InChI=1S/C16H23N3O3S/c1-5-21-8-9-22-15-17-14(12-7-6-10-23-12)19(18-15)13(20)11-16(2,3)4/h6-7,10H,5,8-9,11H2,1-4H3