(2-naphthalen-2-ylsulfonylimino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene)-[[(2S)-oxolan-2-yl]methylamino]methanolate

Systemtic Name: (2-naphthalen-2-ylsulfonylimino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene)-[[(2S)-oxolan-2-yl]methylamino]methanolate Openeye Name: [2-(2-naphthylsulfonylimino)-4,5,6,7-tetrahydrobenzothiophen-3-ylidene]-[[(2S)-tetrahydrofuran-2-yl]methylamino]methanolate CAS Name: [2-(2-naphthalenylsulfonylimino)-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]-[[(2S)-2-oxolanyl]methylamino]methanolate IUPAC Name: (2-naphthalen-2-ylsulfonylimino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene)-[[(2S)-oxolan-2-yl]methylamino]methanolate Traditional Name: [2-(2-naphthylsulfonylimino)-4,5,6,7-tetrahydrobenzothiophen-3-ylidene]-[[(2S)-tetrahydrofuran-2-yl]methylamino]methanolate Formula: C24H25N2O4S2- MolecularWeight: 469.5963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(NCC3CCCO3)[O-])C(=NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)S2

Isomeric SMILES

C1CCC2=C(C1)C(=C(NC[C@@H]3CCCO3)[O-])C(=NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)S2

InChI

InChI=1S/C24H26N2O4S2/c27-23(25-15-18-8-5-13-30-18)22-20-9-3-4-10-21(20)31-24(22)26-32(28,29)19-12-11-16-6-1-2-7-17(16)14-19/h1-2,6-7,11-12,14,18,25,27H,3-5,8-10,13,15H2/p-1/t18-/m0/s1