5-(1,4-diazepan-1-ylsulfonyl)-2-methyl-benzamide

Systemtic Name: 5-(1,4-diazepan-1-ylsulfonyl)-2-methyl-benzamide Openeye Name: 5-(1,4-diazepan-1-ylsulfonyl)-2-methyl-benzamide CAS Name: 5-(1,4-diazepan-1-ylsulfonyl)-2-methylbenzamide IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)-2-methylbenzamide Traditional Name: 5-(1,4-diazepan-1-ylsulfonyl)-2-methyl-benzamide Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCNCC2)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCNCC2)C(=O)N

InChI

InChI=1S/C13H19N3O3S/c1-10-3-4-11(9-12(10)13(14)17)20(18,19)16-7-2-5-15-6-8-16/h3-4,9,15H,2,5-8H2,1H3,(H2,14,17)