(E)-3-(9-ethylcarbazol-3-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(9-ethylcarbazol-3-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile Openeye Name: (E)-3-(9-ethylcarbazol-3-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile CAS Name: (E)-3-(9-ethyl-3-carbazolyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)-2-propenenitrile IUPAC Name: (E)-3-(9-ethylcarbazol-3-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile Traditional Name: (E)-3-(9-ethylcarbazol-3-yl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-yl)acrylonitrile Formula: C24H23N5 MolecularWeight: 381.47292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C=C(C#N)C3=NN=C4N3CCCCC4)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)/C=C(\C#N)/C3=NN=C4N3CCCCC4)C5=CC=CC=C51

InChI

InChI=1S/C24H23N5/c1-2-28-21-9-6-5-8-19(21)20-15-17(11-12-22(20)28)14-18(16-25)24-27-26-23-10-4-3-7-13-29(23)24/h5-6,8-9,11-12,14-15H,2-4,7,10,13H2,1H3/b18-14+