N-(2-azanylethyl)-1-methylsulfonyl-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-methylsulfonyl-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-methylsulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-methylsulfonyl-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-methylsulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-mesyl-hexahydropyrimidine-2-carboxamide Formula: C15H24N4O5S2 MolecularWeight: 404.50486

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(C1C(=O)NCCN)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N1CCCN(C1C(=O)NCCN)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H24N4O5S2/c1-25(21,22)18-10-5-11-19(15(18)14(20)17-9-8-16)26(23,24)12-13-6-3-2-4-7-13/h2-4,6-7,15H,5,8-12,16H2,1H3,(H,17,20)