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

Systemtic Name: 2-(5-pyridin-3-yl-1,2,4-triazol-1-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Openeye Name: 2-[5-(3-pyridyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile CAS Name: 2-[5-(3-pyridinyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile IUPAC Name: 2-(5-pyridin-3-yl-1,2,4-triazol-1-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Traditional Name: 2-[5-(3-pyridyl)-1,2,4-triazol-1-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Formula: C17H15N5S MolecularWeight: 321.3995

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)N3C(=NC=N3)C4=CN=CC=C4

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)N3C(=NC=N3)C4=CN=CC=C4

InChI

InChI=1S/C17H15N5S/c18-9-14-13-6-2-1-3-7-15(13)23-17(14)22-16(20-11-21-22)12-5-4-8-19-10-12/h4-5,8,10-11H,1-3,6-7H2