2-[5-(4-ethoxyphenyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile

Systemtic Name: 2-[5-(4-ethoxyphenyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Openeye Name: 2-[5-(4-ethoxyphenyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile CAS Name: 2-[5-(4-ethoxyphenyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile IUPAC Name: 2-[5-(4-ethoxyphenyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Traditional Name: 2-(5-p-phenetyl-1,2,4-triazol-1-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC=NN2C3=C(C4=C(S3)CCCCC4)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC=NN2C3=C(C4=C(S3)CCCCC4)C#N

InChI

InChI=1S/C20H20N4OS/c1-2-25-15-10-8-14(9-11-15)19-22-13-23-24(19)20-17(12-21)16-6-4-3-5-7-18(16)26-20/h8-11,13H,2-7H2,1H3