[6-(5-chloranylthiophen-2-yl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate

Systemtic Name: [6-(5-chloranylthiophen-2-yl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate Openeye Name: [6-[(5-chloro-2-thienyl)sulfonylimino]cyclohexa-2,4-dien-1-ylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate CAS Name: [6-[(5-chloro-2-thiophenyl)sulfonylimino]-1-cyclohexa-2,4-dienylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate IUPAC Name: [6-(5-chlorothiophen-2-yl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate Traditional Name: [6-[(5-chloro-2-thienyl)sulfonylimino]cyclohexa-2,4-dien-1-ylidene]-(3,4-dihydro-1H-isoquinolin-2-yl)methanolate Formula: C20H16ClN2O3S2- MolecularWeight: 431.93564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=C3C=CC=CC3=NS(=O)(=O)C4=CC=C(S4)Cl)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=C3C=CC=CC3=NS(=O)(=O)C4=CC=C(S4)Cl)[O-]

InChI

InChI=1S/C20H17ClN2O3S2/c21-18-9-10-19(27-18)28(25,26)22-17-8-4-3-7-16(17)20(24)23-12-11-14-5-1-2-6-15(14)13-23/h1-10,24H,11-13H2/p-1