N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-[bis(2-hydroxyethyl)amino]-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-[bis(2-hydroxyethyl)amino]-N-methyl-benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-[bis(2-hydroxyethyl)amino]-N-methyl-benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-[bis(2-hydroxyethyl)amino]-N-methylbenzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-[bis(2-hydroxyethyl)amino]-N-methylbenzenesulfonamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-[bis(2-hydroxyethyl)amino]-N-methyl-benzenesulfonamide Formula: C24H33N3O4S2 MolecularWeight: 491.66652

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)N(CCO)CCO

Isomeric SMILES

CN(C1=NC(=CS1)C23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC=C(C=C5)N(CCO)CCO

InChI

InChI=1S/C24H33N3O4S2/c1-26(33(30,31)21-4-2-20(3-5-21)27(6-8-28)7-9-29)23-25-22(16-32-23)24-13-17-10-18(14-24)12-19(11-17)15-24/h2-5,16-19,28-29H,6-15H2,1H3