[1-(furan-2-ylcarbonyl)piperidin-3-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: [1-(furan-2-ylcarbonyl)piperidin-3-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone Openeye Name: [1-(furan-2-carbonyl)-3-piperidyl]-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]methanone CAS Name: [1-[2-furanyl(oxo)methyl]-3-piperidinyl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone IUPAC Name: [1-(furan-2-carbonyl)piperidin-3-yl]-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]methanone Traditional Name: [1-(2-furoyl)-3-piperidyl]-(4-tosyl-1,4-diazepan-1-yl)methanone Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3CCCN(C3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3CCCN(C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C23H29N3O5S/c1-18-7-9-20(10-8-18)32(29,30)26-13-4-12-24(14-15-26)22(27)19-5-2-11-25(17-19)23(28)21-6-3-16-31-21/h3,6-10,16,19H,2,4-5,11-15,17H2,1H3