1-[[1-(phenylmethyl)imidazol-2-yl]methyl]-4-thiophen-2-ylsulfonyl-1,4-diazepane

Systemtic Name: 1-[[1-(phenylmethyl)imidazol-2-yl]methyl]-4-thiophen-2-ylsulfonyl-1,4-diazepane Openeye Name: 1-[(1-benzylimidazol-2-yl)methyl]-4-(2-thienylsulfonyl)-1,4-diazepane CAS Name: 1-[[1-(phenylmethyl)-2-imidazolyl]methyl]-4-thiophen-2-ylsulfonyl-1,4-diazepane IUPAC Name: 1-[(1-benzylimidazol-2-yl)methyl]-4-thiophen-2-ylsulfonyl-1,4-diazepane Traditional Name: 1-[(1-benzylimidazol-2-yl)methyl]-4-(2-thienylsulfonyl)-1,4-diazepane Formula: C20H24N4O2S2 MolecularWeight: 416.56016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=CS2)CC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H24N4O2S2/c25-28(26,20-8-4-15-27-20)24-11-5-10-22(13-14-24)17-19-21-9-12-23(19)16-18-6-2-1-3-7-18/h1-4,6-9,12,15H,5,10-11,13-14,16-17H2