4-[4-methyl-2-[[6-(3-oxidanylpropylamino)pyrazin-2-yl]methyl]-1,3-thiazol-5-yl]benzenesulfonamide

Systemtic Name: 4-[4-methyl-2-[[6-(3-oxidanylpropylamino)pyrazin-2-yl]methyl]-1,3-thiazol-5-yl]benzenesulfonamide Openeye Name: 4-[2-[[6-(3-hydroxypropylamino)pyrazin-2-yl]methyl]-4-methyl-thiazol-5-yl]benzenesulfonamide CAS Name: 4-[2-[[6-(3-hydroxypropylamino)-2-pyrazinyl]methyl]-4-methyl-5-thiazolyl]benzenesulfonamide IUPAC Name: 4-[2-[[6-(3-hydroxypropylamino)pyrazin-2-yl]methyl]-4-methyl-1,3-thiazol-5-yl]benzenesulfonamide Traditional Name: 4-[2-[[6-(3-hydroxypropylamino)pyrazin-2-yl]methyl]-4-methyl-thiazol-5-yl]benzenesulfonamide Formula: C18H21N5O3S2 MolecularWeight: 419.52104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CN=CC(=N2)NCCCO)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(SC(=N1)CC2=CN=CC(=N2)NCCCO)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H21N5O3S2/c1-12-18(13-3-5-15(6-4-13)28(19,25)26)27-17(22-12)9-14-10-20-11-16(23-14)21-7-2-8-24/h3-6,10-11,24H,2,7-9H2,1H3,(H,21,23)(H2,19,25,26)