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

Systemtic Name: [methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]-(4-thiophen-2-ylsulfonyliminocyclohexa-2,5-dien-1-ylidene)methanolate Openeye Name: [methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]-[4-(2-thienylsulfonylimino)cyclohexa-2,5-dien-1-ylidene]methanolate CAS Name: [methyl-[[2-(1-pyrrolidinyl)phenyl]methyl]amino]-(4-thiophen-2-ylsulfonylimino-1-cyclohexa-2,5-dienylidene)methanolate IUPAC Name: [methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]-(4-thiophen-2-ylsulfonyliminocyclohexa-2,5-dien-1-ylidene)methanolate Traditional Name: [methyl-(2-pyrrolidinobenzyl)amino]-[4-(2-thienylsulfonylimino)cyclohexa-2,5-dien-1-ylidene]methanolate Formula: C23H24N3O3S2- MolecularWeight: 454.58496

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)C(=C3C=CC(=NS(=O)(=O)C4=CC=CS4)C=C3)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)C(=C3C=CC(=NS(=O)(=O)C4=CC=CS4)C=C3)[O-]

InChI

InChI=1S/C23H25N3O3S2/c1-25(17-19-7-2-3-8-21(19)26-14-4-5-15-26)23(27)18-10-12-20(13-11-18)24-31(28,29)22-9-6-16-30-22/h2-3,6-13,16,27H,4-5,14-15,17H2,1H3/p-1