4-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole

Systemtic Name: 4-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole Openeye Name: 4-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanylmethyl]-2-(2-furyl)thiazole CAS Name: 4-[[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]methyl]-2-(2-furanyl)thiazole IUPAC Name: 4-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-2-(furan-2-yl)-1,3-thiazole Traditional Name: 4-[[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]methyl]-2-(2-furyl)thiazole Formula: C19H21N3O3S3 MolecularWeight: 435.58334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CSC(=N3)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CSC(=N3)C4=CC=CO4

InChI

InChI=1S/C19H21N3O3S3/c23-28(24,22-9-3-1-2-4-10-22)16-7-8-18(20-12-16)26-13-15-14-27-19(21-15)17-6-5-11-25-17/h5-8,11-12,14H,1-4,9-10,13H2