1-(phenylmethyl)sulfonyl-4-(pyridin-2-ylmethyl)-1,4-diazepane

Systemtic Name: 1-(phenylmethyl)sulfonyl-4-(pyridin-2-ylmethyl)-1,4-diazepane Openeye Name: 1-benzylsulfonyl-4-(2-pyridylmethyl)-1,4-diazepane CAS Name: 1-(phenylmethyl)sulfonyl-4-(2-pyridinylmethyl)-1,4-diazepane IUPAC Name: 1-benzylsulfonyl-4-(pyridin-2-ylmethyl)-1,4-diazepane Traditional Name: 1-benzylsulfonyl-4-(2-pyridylmethyl)-1,4-diazepane Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)CC2=CC=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)CC2=CC=CC=C2)CC3=CC=CC=N3

InChI

InChI=1S/C18H23N3O2S/c22-24(23,16-17-7-2-1-3-8-17)21-12-6-11-20(13-14-21)15-18-9-4-5-10-19-18/h1-5,7-10H,6,11-16H2