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

Systemtic Name: N-(2-azanylethyl)-1-(oxolan-2-ylcarbonyl)-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[oxo(2-oxolanyl)methyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(oxolane-2-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-2-carboxamide Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H28N4O5S/c20-9-10-21-17(24)18-22(19(25)16-8-4-13-28-16)11-5-12-23(18)29(26,27)14-15-6-2-1-3-7-15/h1-3,6-7,16,18H,4-5,8-14,20H2,(H,21,24)