1-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane Openeye Name: 1-(2-furylmethyl)-4-(p-tolylsulfonyl)-1,4-diazepane CAS Name: 1-(2-furanylmethyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane IUPAC Name: 1-(furan-2-ylmethyl)-4-(4-methylphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-(2-furfuryl)-4-tosyl-1,4-diazepane Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C17H22N2O3S/c1-15-5-7-17(8-6-15)23(20,21)19-10-3-9-18(11-12-19)14-16-4-2-13-22-16/h2,4-8,13H,3,9-12,14H2,1H3