1-(furan-2-ylmethyl)-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane

Systemtic Name: 1-(furan-2-ylmethyl)-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane Openeye Name: 1-(2-furylmethyl)-4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepane CAS Name: 1-(2-furanylmethyl)-4-[2-(1-naphthalenyl)ethylsulfonyl]-1,4-diazepane IUPAC Name: 1-(furan-2-ylmethyl)-4-(2-naphthalen-1-ylethylsulfonyl)-1,4-diazepane Traditional Name: 1-(2-furfuryl)-4-[2-(1-naphthyl)ethylsulfonyl]-1,4-diazepane Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)CC4=CC=CO4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)CCC2=CC=CC3=CC=CC=C32)CC4=CC=CO4

InChI

InChI=1S/C22H26N2O3S/c25-28(26,17-11-20-8-3-7-19-6-1-2-10-22(19)20)24-13-5-12-23(14-15-24)18-21-9-4-16-27-21/h1-4,6-10,16H,5,11-15,17-18H2