methyl N-[2-[(6-ethylsulfonyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)sulfanylmethyl]phenyl]carbamate

Systemtic Name: methyl N-[2-[(6-ethylsulfonyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)sulfanylmethyl]phenyl]carbamate Openeye Name: methyl N-[2-[(6-ethylsulfonyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)sulfanylmethyl]phenyl]carbamate CAS Name: N-[2-[[(6-ethylsulfonyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)thio]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[(6-ethylsulfonyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)sulfanylmethyl]phenyl]carbamate Traditional Name: N-[2-[[(6-esyl-4-methoxy-2,3-dihydro-1,4-benzoxazin-3-yl)thio]methyl]phenyl]carbamic acid methyl ester Formula: C20H24N2O6S2 MolecularWeight: 452.54436

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(N2OC)SCC3=CC=CC=C3NC(=O)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(N2OC)SCC3=CC=CC=C3NC(=O)OC

InChI

InChI=1S/C20H24N2O6S2/c1-4-30(24,25)15-9-10-18-17(11-15)22(27-3)19(12-28-18)29-13-14-7-5-6-8-16(14)21-20(23)26-2/h5-11,19H,4,12-13H2,1-3H3,(H,21,23)