3-[3-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[1-oxo-2-(5-thiophen-2-yl-2-tetrazolyl)ethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]indol-1-yl]propionitrile Formula: C18H14N6OS MolecularWeight: 362.40836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)CN3N=C(N=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)CN3N=C(N=N3)C4=CC=CS4

InChI

InChI=1S/C18H14N6OS/c19-8-4-9-23-11-14(13-5-1-2-6-15(13)23)16(25)12-24-21-18(20-22-24)17-7-3-10-26-17/h1-3,5-7,10-11H,4,9,12H2