tert-butyl N-[[3-[4-(4-aminocarbonyl-2-piperidin-1-ylsulfonyl-oxan-4-yl)-2-methyl-phenyl]phenyl]methyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[[3-[4-(4-aminocarbonyl-2-piperidin-1-ylsulfonyl-oxan-4-yl)-2-methyl-phenyl]phenyl]methyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[[3-[4-[4-carbamoyl-2-(1-piperidylsulfonyl)tetrahydropyran-4-yl]-2-methyl-phenyl]phenyl]methyl]-N-methyl-carbamate CAS Name: N-[[3-[4-[4-carbamoyl-2-(1-piperidinylsulfonyl)-4-oxanyl]-2-methylphenyl]phenyl]methyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-[4-(4-carbamoyl-2-piperidin-1-ylsulfonyloxan-4-yl)-2-methylphenyl]phenyl]methyl]-N-methylcarbamate Traditional Name: N-[3-[4-(4-carbamoyl-2-piperidinosulfonyl-tetrahydropyran-4-yl)-2-methyl-phenyl]benzyl]-N-methyl-carbamic acid tert-butyl ester Formula: C31H43N3O6S MolecularWeight: 585.75462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCOC(C2)S(=O)(=O)N3CCCCC3)C(=O)N)C4=CC(=CC=C4)CN(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCOC(C2)S(=O)(=O)N3CCCCC3)C(=O)N)C4=CC(=CC=C4)CN(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H43N3O6S/c1-22-18-25(31(28(32)35)14-17-39-27(20-31)41(37,38)34-15-7-6-8-16-34)12-13-26(22)24-11-9-10-23(19-24)21-33(5)29(36)40-30(2,3)4/h9-13,18-19,27H,6-8,14-17,20-21H2,1-5H3,(H2,32,35)