2-(5-isocyanothiophen-2-yl)-5-piperazin-1-yl-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(5-isocyanothiophen-2-yl)-5-piperazin-1-yl-2-propan-2-yl-pentanenitrile Openeye Name: 2-(5-isocyano-2-thienyl)-2-isopropyl-5-piperazin-1-yl-pentanenitrile CAS Name: 2-(5-isocyano-2-thiophenyl)-5-(1-piperazinyl)-2-propan-2-ylpentanenitrile IUPAC Name: 2-(5-isocyanothiophen-2-yl)-5-piperazin-1-yl-2-propan-2-ylpentanenitrile Traditional Name: 2-(5-isocyano-2-thienyl)-2-isopropyl-5-piperazino-valeronitrile Formula: C17H24N4S MolecularWeight: 316.46426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCNCC1)(C#N)C2=CC=C(S2)[N+]#[C-]

Isomeric SMILES

CC(C)C(CCCN1CCNCC1)(C#N)C2=CC=C(S2)[N+]#[C-]

InChI

InChI=1S/C17H24N4S/c1-14(2)17(13-18,15-5-6-16(19-3)22-15)7-4-10-21-11-8-20-9-12-21/h5-6,14,20H,4,7-12H2,1-2H3