N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[1-[4-(3-chlorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C23H27ClN4O5S2 MolecularWeight: 539.06728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)OC1=O

InChI

InChI=1S/C23H27ClN4O5S2/c1-26-20-7-6-18(15-21(20)33-23(26)30)35(31,32)25-19(8-13-34-2)22(29)28-11-9-27(10-12-28)17-5-3-4-16(24)14-17/h3-7,14-15,19,25H,8-13H2,1-2H3