N-[3-(4-methylpiperazin-1-yl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[3-(4-methyl-1-piperazinyl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[3-(4-methylpiperazin-1-yl)propyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-N-[3-(4-methylpiperazino)propyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C

InChI

InChI=1S/C18H28N4O4S/c1-20-10-12-21(13-11-20)9-5-8-19-18(23)17-14-22(27(2,24)25)15-6-3-4-7-16(15)26-17/h3-4,6-7,17H,5,8-14H2,1-2H3,(H,19,23)