1-(pyridin-3-ylmethyl)-4-thiophen-2-ylsulfonyl-1,4-diazepane

Systemtic Name: 1-(pyridin-3-ylmethyl)-4-thiophen-2-ylsulfonyl-1,4-diazepane Openeye Name: 1-(3-pyridylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepane CAS Name: 1-(3-pyridinylmethyl)-4-thiophen-2-ylsulfonyl-1,4-diazepane IUPAC Name: 1-(pyridin-3-ylmethyl)-4-thiophen-2-ylsulfonyl-1,4-diazepane Traditional Name: 1-(3-pyridylmethyl)-4-(2-thienylsulfonyl)-1,4-diazepane Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=CN=CC=C3

InChI

InChI=1S/C15H19N3O2S2/c19-22(20,15-5-2-11-21-15)18-8-3-7-17(9-10-18)13-14-4-1-6-16-12-14/h1-2,4-6,11-12H,3,7-10,13H2