methyl 1,2,5-trimethyl-4-[4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-2-yl]pyrrole-3-carboxylate

Systemtic Name: methyl 1,2,5-trimethyl-4-[4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-2-yl]pyrrole-3-carboxylate Openeye Name: methyl 4-(3-benzyl-4-oxo-1,3-thiazinan-2-yl)-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 1,2,5-trimethyl-4-[4-oxo-3-(phenylmethyl)-1,3-thiazinan-2-yl]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-benzyl-4-oxo-1,3-thiazinan-2-yl)-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-(3-benzyl-4-keto-1,3-thiazinan-2-yl)-1,2,5-trimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)C(=O)OC)C2N(C(=O)CCS2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(N1C)C)C(=O)OC)C2N(C(=O)CCS2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3S/c1-13-17(18(20(24)25-4)14(2)21(13)3)19-22(16(23)10-11-26-19)12-15-8-6-5-7-9-15/h5-9,19H,10-12H2,1-4H3