N-[1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[1-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide CAS Name: N-[1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methyl-2-oxo-1,3-benzoxazole-6-sulfonamide Traditional Name: N-[1-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-keto-3-methyl-1,3-benzoxazole-6-sulfonamide Formula: C24H29ClN4O5S2 MolecularWeight: 553.09386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C(CCSC)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C(CCSC)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

InChI

InChI=1S/C24H29ClN4O5S2/c1-16-4-5-17(25)14-21(16)28-9-11-29(12-10-28)23(30)19(8-13-35-3)26-36(32,33)18-6-7-20-22(15-18)34-24(31)27(20)2/h4-7,14-15,19,26H,8-13H2,1-3H3