N-[1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[1-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-3-methylsulfanyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-4-(methylthio)-1-oxobutan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[1-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-3-(methylthio)propyl]-4-methyl-benzenesulfonamide Formula: C24H29N3O4S2 MolecularWeight: 487.63476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H29N3O4S2/c1-17-7-9-19(10-8-17)33(29,30)26-21(13-16-32-2)24(28)27-14-11-18(12-15-27)23-25-20-5-3-4-6-22(20)31-23/h3-10,18,21,26H,11-16H2,1-2H3