4-(3-methyl-4-methylsulfonyl-piperazin-1-yl)-2-(oxan-4-yl)aniline

Systemtic Name: 4-(3-methyl-4-methylsulfonyl-piperazin-1-yl)-2-(oxan-4-yl)aniline Openeye Name: 4-(3-methyl-4-methylsulfonyl-piperazin-1-yl)-2-tetrahydropyran-4-yl-aniline CAS Name: 4-(3-methyl-4-methylsulfonyl-1-piperazinyl)-2-(4-oxanyl)aniline IUPAC Name: 4-(3-methyl-4-methylsulfonylpiperazin-1-yl)-2-(oxan-4-yl)aniline Traditional Name: [4-(4-mesyl-3-methyl-piperazino)-2-tetrahydropyran-4-yl-phenyl]amine Formula: C17H27N3O3S MolecularWeight: 353.47958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C)C2=CC(=C(C=C2)N)C3CCOCC3

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C)C2=CC(=C(C=C2)N)C3CCOCC3

InChI

InChI=1S/C17H27N3O3S/c1-13-12-19(7-8-20(13)24(2,21)22)15-3-4-17(18)16(11-15)14-5-9-23-10-6-14/h3-4,11,13-14H,5-10,12,18H2,1-2H3