4-ethylsulfonyl-N-[2-(prop-2-enylcarbamoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-ethylsulfonyl-N-[2-(prop-2-enylcarbamoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[2-(allylcarbamoyl)phenyl]-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-ethylsulfonyl-N-[2-[oxo-(prop-2-enylamino)methyl]phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-ethylsulfonyl-N-[2-(prop-2-enylcarbamoyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[2-(allylcarbamoyl)phenyl]-4-esyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=CC=CC=C3C(=O)NCC=C

Isomeric SMILES

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=CC=CC=C3C(=O)NCC=C

InChI

InChI=1S/C21H23N3O5S/c1-3-13-22-20(25)15-9-5-6-10-16(15)23-21(26)19-14-24(30(27,28)4-2)17-11-7-8-12-18(17)29-19/h3,5-12,19H,1,4,13-14H2,2H3,(H,22,25)(H,23,26)