4-(4-pyridin-4-ylbutyl)-5H-1,4-thiazepine

Systemtic Name: 4-(4-pyridin-4-ylbutyl)-5H-1,4-thiazepine Openeye Name: 4-[4-(4-pyridyl)butyl]-5H-1,4-thiazepine CAS Name: 4-(4-pyridin-4-ylbutyl)-5H-1,4-thiazepine IUPAC Name: 4-(4-pyridin-4-ylbutyl)-5H-1,4-thiazepine Traditional Name: 4-[4-(4-pyridyl)butyl]-5H-1,4-thiazepine Formula: C14H18N2S MolecularWeight: 246.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CSC=CN1CCCCC2=CC=NC=C2

Isomeric SMILES

C1C=CSC=CN1CCCCC2=CC=NC=C2

InChI

InChI=1S/C14H18N2S/c1(4-14-5-7-15-8-6-14)2-9-16-10-3-12-17-13-11-16/h3,5-8,11-13H,1-2,4,9-10H2