2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]-N-(cyclohexen-1-yl)-N-(2-furylmethyl)acetamide CAS Name: 2-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-N-(1-cyclohexenyl)-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]-N-(cyclohexen-1-yl)-N-(2-furfuryl)acetamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)N(CC3=CC=CO3)C4=CCCCC4

InChI

InChI=1S/C24H31N3O4S2/c28-24(27(18-21-11-8-16-31-21)20-9-4-3-5-10-20)19-32-23-13-12-22(17-25-23)33(29,30)26-14-6-1-2-7-15-26/h8-9,11-13,16-17H,1-7,10,14-15,18-19H2