2-(4-methylsulfonylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-3-(oxan-4-yl)propanamide

Systemtic Name: 2-(4-methylsulfonylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-3-(oxan-4-yl)propanamide Openeye Name: 2-(4-methylsulfonylphenyl)-N-(5-nitrothiazol-2-yl)-3-tetrahydropyran-4-yl-propanamide CAS Name: 2-(4-methylsulfonylphenyl)-N-(5-nitro-2-thiazolyl)-3-(4-oxanyl)propanamide IUPAC Name: 2-(4-methylsulfonylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-3-(oxan-4-yl)propanamide Traditional Name: 2-(4-mesylphenyl)-N-(5-nitrothiazol-2-yl)-3-tetrahydropyran-4-yl-propionamide Formula: C18H21N3O6S2 MolecularWeight: 439.50584

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCOCC2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCOCC2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O6S2/c1-29(25,26)14-4-2-13(3-5-14)15(10-12-6-8-27-9-7-12)17(22)20-18-19-11-16(28-18)21(23)24/h2-5,11-12,15H,6-10H2,1H3,(H,19,20,22)