7-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxo-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one CAS Name: 7-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-oxopropyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-[3-[4-(2,5-dimethylphenyl)piperazino]-3-keto-propyl]sulfonyl-6-methyl-4H-1,4-benzoxazin-3-one Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3C)NC(=O)CO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3C)NC(=O)CO4

InChI

InChI=1S/C24H29N3O5S/c1-16-4-5-17(2)20(12-16)26-7-9-27(10-8-26)24(29)6-11-33(30,31)22-14-21-19(13-18(22)3)25-23(28)15-32-21/h4-5,12-14H,6-11,15H2,1-3H3,(H,25,28)