N-[(2S)-2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]naphthalene-2-sulfonamide

Systemtic Name: N-[(2S)-2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]naphthalene-2-sulfonamide Openeye Name: N-[(2S)-2-(azepan-1-yl)-2-(3-thienyl)ethyl]naphthalene-2-sulfonamide CAS Name: N-[(2S)-2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-2-naphthalenesulfonamide IUPAC Name: N-[(2S)-2-(azepan-1-yl)-2-thiophen-3-ylethyl]naphthalene-2-sulfonamide Traditional Name: N-[(2S)-2-(azepan-1-yl)-2-(3-thienyl)ethyl]naphthalene-2-sulfonamide Formula: C22H26N2O2S2 MolecularWeight: 414.58404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CSC=C4

Isomeric SMILES

C1CCCN(CC1)[C@H](CNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=CSC=C4

InChI

InChI=1S/C22H26N2O2S2/c25-28(26,21-10-9-18-7-3-4-8-19(18)15-21)23-16-22(20-11-14-27-17-20)24-12-5-1-2-6-13-24/h3-4,7-11,14-15,17,22-23H,1-2,5-6,12-13,16H2/t22-/m1/s1