(phenylmethyl) 5-azanyl-2-methyl-4-sulfanylidene-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylate

Systemtic Name: (phenylmethyl) 5-azanyl-2-methyl-4-sulfanylidene-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylate Openeye Name: benzyl 5-amino-2-methyl-4-thioxo-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylate CAS Name: 5-amino-2-methyl-4-sulfanylidene-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-amino-2-methyl-4-sulfanylidene-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylate Traditional Name: 5-amino-2-methyl-4-thioxo-9bH-pyrano[4,3-a]pyrrolizine-1-carboxylic acid benzyl ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2C3=CC=CN3C(=C2C(=S)O1)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2C3=CC=CN3C(=C2C(=S)O1)N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H16N2O3S/c1-11-14(18(22)23-10-12-6-3-2-4-7-12)15-13-8-5-9-21(13)17(20)16(15)19(25)24-11/h2-9,15H,10,20H2,1H3