N-(3-methoxyphenyl)-5-(4-piperidin-1-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine hydrochloride

Systemtic Name: N-(3-methoxyphenyl)-5-(4-piperidin-1-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine hydrochloride Openeye Name: N-(3-methoxyphenyl)-5-[4-(1-piperidylsulfonyl)phenyl]-6H-1,3,4-thiadiazin-2-amine hydrochloride CAS Name: N-(3-methoxyphenyl)-5-[4-(1-piperidinylsulfonyl)phenyl]-6H-1,3,4-thiadiazin-2-amine hydrochloride IUPAC Name: N-(3-methoxyphenyl)-5-(4-piperidin-1-ylsulfonylphenyl)-6H-1,3,4-thiadiazin-2-amine hydrochloride Traditional Name: (3-methoxyphenyl)-[5-(4-piperidinosulfonylphenyl)-6H-1,3,4-thiadiazin-2-yl]amine hydrochloride Formula: C21H25ClN4O3S2 MolecularWeight: 481.0312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4.Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4.Cl

InChI

InChI=1S/C21H24N4O3S2.ClH/c1-28-18-7-5-6-17(14-18)22-21-24-23-20(15-29-21)16-8-10-19(11-9-16)30(26,27)25-12-3-2-4-13-25;/h5-11,14H,2-4,12-13,15H2,1H3,(H,22,24);1H