2-[[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-[[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole Openeye Name: 2-[[4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepan-1-yl]methyl]thiazole CAS Name: 2-[[4-[2-(1-naphthalenyl)ethylsulfonyl]-1,4-diazepan-1-yl]methyl]thiazole IUPAC Name: 2-[[4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepan-1-yl]methyl]-1,3-thiazole Traditional Name: 2-[[4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepan-1-yl]methyl]thiazole Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)CC4=NC=CS4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)CC4=NC=CS4

InChI

InChI=1S/C21H25N3O2S2/c25-28(26,16-9-19-7-3-6-18-5-1-2-8-20(18)19)24-12-4-11-23(13-14-24)17-21-22-10-15-27-21/h1-3,5-8,10,15H,4,9,11-14,16-17H2