N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-(2-methyl-5-piperidinosulfonyl-phenyl)propionamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O5S/c1-17-9-10-18(32(29,30)25-12-5-2-6-13-25)15-19(17)24-22(27)11-14-26-20-7-3-4-8-21(20)31-16-23(26)28/h3-4,7-10,15H,2,5-6,11-14,16H2,1H3,(H,24,27)