(phenylmethyl) 6-methyl-5-oxidanylidene-4-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate

Systemtic Name: (phenylmethyl) 6-methyl-5-oxidanylidene-4-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate Openeye Name: benzyl 6-methyl-5-oxo-4-thiazol-2-yl-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate CAS Name: 6-methyl-5-oxo-4-(2-thiazolyl)-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-methyl-5-oxo-4-(1,3-thiazol-2-yl)-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylate Traditional Name: 5-keto-6-methyl-4-thiazol-2-yl-3,6-dihydro-2H-pyrrolo[3,2-b]pyrrole-1-carboxylic acid benzyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CCN2C(=O)OCC3=CC=CC=C3)N(C1=O)C4=NC=CS4

Isomeric SMILES

CC1C2=C(CCN2C(=O)OCC3=CC=CC=C3)N(C1=O)C4=NC=CS4

InChI

InChI=1S/C18H17N3O3S/c1-12-15-14(21(16(12)22)17-19-8-10-25-17)7-9-20(15)18(23)24-11-13-5-3-2-4-6-13/h2-6,8,10,12H,7,9,11H2,1H3