[butyl(methyl)amino]-(4-thiophen-2-ylsulfonyliminocyclohexa-2,5-dien-1-ylidene)methanolate

Systemtic Name: [butyl(methyl)amino]-(4-thiophen-2-ylsulfonyliminocyclohexa-2,5-dien-1-ylidene)methanolate Openeye Name: [butyl(methyl)amino]-[4-(2-thienylsulfonylimino)cyclohexa-2,5-dien-1-ylidene]methanolate CAS Name: [butyl(methyl)amino]-(4-thiophen-2-ylsulfonylimino-1-cyclohexa-2,5-dienylidene)methanolate IUPAC Name: [butyl(methyl)amino]-(4-thiophen-2-ylsulfonyliminocyclohexa-2,5-dien-1-ylidene)methanolate Traditional Name: [butyl(methyl)amino]-[4-(2-thienylsulfonylimino)cyclohexa-2,5-dien-1-ylidene]methanolate Formula: C16H19N2O3S2- MolecularWeight: 351.46366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=C1C=CC(=NS(=O)(=O)C2=CC=CS2)C=C1)[O-]

Isomeric SMILES

CCCCN(C)C(=C1C=CC(=NS(=O)(=O)C2=CC=CS2)C=C1)[O-]

InChI

InChI=1S/C16H20N2O3S2/c1-3-4-11-18(2)16(19)13-7-9-14(10-8-13)17-23(20,21)15-6-5-12-22-15/h5-10,12,19H,3-4,11H2,1-2H3/p-1