N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-sulfonamide hydrochloride

Systemtic Name: N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]-6-sulfanylidene-cyclohexa-1,3-diene-1-sulfonamide hydrochloride Openeye Name: N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]-6-thioxo-cyclohexa-1,3-diene-1-sulfonamide hydrochloride CAS Name: N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]-6-sulfanylidene-1-cyclohexa-1,3-dienesulfonamide hydrochloride IUPAC Name: N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]-6-sulfanylidenecyclohexa-1,3-diene-1-sulfonamide hydrochloride Traditional Name: N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]-6-thioxo-cyclohexa-1,3-diene-1-sulfonamide hydrochloride Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=CCC3=S.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=CCC3=S.Cl

InChI

InChI=1S/C20H21N3O3S2.ClH/c1-15-12-17(23-28(24,25)20-5-3-2-4-19(20)27)14-18(13-15)26-11-10-22-16-6-8-21-9-7-16;/h2-3,5-9,12-14,23H,4,10-11H2,1H3,(H,21,22);1H