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

Systemtic Name: methyl 4-[3-[(3-methoxyphenyl)methyl]-4-oxidanylidene-1,3-thiazinan-2-yl]-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-[3-[(3-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-yl]-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[3-[(3-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-yl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-[(3-methoxyphenyl)methyl]-4-oxo-1,3-thiazinan-2-yl]-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-(4-keto-3-m-anisyl-1,3-thiazinan-2-yl)-1,2,5-trimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4S/c1-13-18(19(21(25)27-5)14(2)22(13)3)20-23(17(24)9-10-28-20)12-15-7-6-8-16(11-15)26-4/h6-8,11,20H,9-10,12H2,1-5H3