prop-2-enyl 2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl)-2-oxidanylidene-propyl]-3-oxidanyl-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[3-(7-bromanyl-6-chloranyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl)-2-oxidanylidene-propyl]-3-oxidanyl-piperidine-1-carboxylate Openeye Name: allyl 2-[3-(7-bromo-6-chloro-4-oxo-thieno[3,2-d]pyrimidin-3-yl)-2-oxo-propyl]-3-hydroxy-piperidine-1-carboxylate CAS Name: 2-[3-(7-bromo-6-chloro-4-oxo-3-thieno[3,2-d]pyrimidinyl)-2-oxopropyl]-3-hydroxy-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[3-(7-bromo-6-chloro-4-oxothieno[3,2-d]pyrimidin-3-yl)-2-oxopropyl]-3-hydroxypiperidine-1-carboxylate Traditional Name: 2-[3-(7-bromo-6-chloro-4-keto-thieno[3,2-d]pyrimidin-3-yl)-2-keto-propyl]-3-hydroxy-piperidine-1-carboxylic acid allyl ester Formula: C18H19BrClN3O5S MolecularWeight: 504.78256

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CCCC(C1CC(=O)CN2C=NC3=C(C2=O)SC(=C3Br)Cl)O

Isomeric SMILES

C=CCOC(=O)N1CCCC(C1CC(=O)CN2C=NC3=C(C2=O)SC(=C3Br)Cl)O

InChI

InChI=1S/C18H19BrClN3O5S/c1-2-6-28-18(27)23-5-3-4-12(25)11(23)7-10(24)8-22-9-21-14-13(19)16(20)29-15(14)17(22)26/h2,9,11-12,25H,1,3-8H2